mdrun.debug

Opening library file /usr/local/gromacs/share/gromacs/top/bromacs.dat
symtab (100):
   symtab[0]="P5"
ffparams->atnr = 15, ntypes = 405
functype (405):
   functype[0]=34
c6= 1.50910005e-01, c12= 1.62670005e-03
b0A= 3.50000e-01, cbA= 4.00000e+02, b0B= 3.50000e-01, cbB= 4.00000e+02
b0A= 3.50000e-01, cbA= 1.25000e+03, b0B= 3.50000e-01, cbB= 1.25000e+03
b0A= 3.50000e-01, cbA= 5.00000e+02, b0B= 3.50000e-01, cbB= 5.00000e+02
b0A= 2.50000e-01, cbA= 7.50000e+03, b0B= 2.50000e-01, cbB= 7.50000e+03
   atomtype[ 12]={radius=-1.00000e+00, volume=-1.00000e+00, gb_radius=-1.00000e+00, surftens=-1.00000e+00, atomnumber=  -1, S_hct=-1.00000e+00)}
   atomtype[ 13]={radius=-1.00000e+00, volume=-1.00000e+00, gb_radius=-1.00000e+00, surftens=-1.00000e+00, atomnumber=  -1, S_hct=-1.00000e+00)}
   atomtype[ 14]={radius=-1.00000e+00, volume=-1.00000e+00, gb_radius=-1.00000e+00, surftens=-1.00000e+00, atomnumber=  -1, S_hct=-1.00000e+00)}
inputrec:
   integrator           = md
   nsteps               = 10000
   init-step            = 0
   cutoff-scheme        = Group
   ns_type              = Grid
   nstlist              = 10
   ndelta               = 2
   nstcomm              = 100
   comm-mode            = Linear
   nstlog               = 500
   nstxout              = 10000
   nstvout              = 0
   nstfout              = 10000
   nstcalcenergy        = 100
   nstenergy            = 500
   nstxtcout            = 1000
   init-t               = 0
   delta-t              = 0.02
   xtcprec              = 100
   fourierspacing       = 0.12
   nkx                  = 0
   nky                  = 0
   nkz                  = 0
   pme-order            = 4
   ewald-rtol           = 1e-05
   ewald-geometry       = 0
   epsilon-surface      = 0
   optimize-fft         = FALSE
   ePBC                 = xyz
   bPeriodicMols        = FALSE
   bContinuation        = FALSE
   bShakeSOR            = FALSE
   etc                  = Berendsen
   bPrintNHChains       = FALSE
   nsttcouple           = 10
   epc                  = Berendsen
   epctype              = Isotropic
   nstpcouple           = 10
   tau-p                = 5
   ref-p (3x3):
      ref-p[    0]={ 1.00000e+00,  0.00000e+00,  0.00000e+00}
      ref-p[    1]={ 0.00000e+00,  1.00000e+00,  0.00000e+00}
      ref-p[    2]={ 0.00000e+00,  0.00000e+00,  1.00000e+00}
   compress (3x3):
      compress[    0]={ 3.00000e-04,  0.00000e+00,  0.00000e+00}
      compress[    1]={ 0.00000e+00,  3.00000e-04,  0.00000e+00}
      compress[    2]={ 0.00000e+00,  0.00000e+00,  3.00000e-04}
   refcoord-scaling     = No
   posres-com (3):
      posres-com[0]= 0.00000e+00
      posres-com[1]= 0.00000e+00
      posres-com[2]= 0.00000e+00
   posres-comB (3):
      posres-comB[0]= 0.00000e+00
      posres-comB[1]= 0.00000e+00
      posres-comB[2]= 0.00000e+00
   verlet-buffer-drift  = 0.005
   rlist                = 1.4
   rlistlong            = 1.4
   nstcalclr            = 0
   rtpi                 = 0.05
   coulombtype          = Shift
   coulomb-modifier     = None
   rcoulomb-switch      = 0
   rcoulomb             = 1.2
   vdwtype              = Shift
   vdw-modifier         = None
   rvdw-switch          = 0.9
   rvdw                 = 1.2
   epsilon-r            = 15
   epsilon-rf           = inf
   tabext               = 1
   implicit-solvent     = No
   gb-algorithm         = Still
   gb-epsilon-solvent   = 80
   nstgbradii           = 1
   rgbradii             = 1
   gb-saltconc          = 0
   gb-obc-alpha         = 1
   gb-obc-beta          = 0.8
   gb-obc-gamma         = 4.85
   gb-dielectric-offset = 0.009
   sa-algorithm         = Ace-approximation
   sa-surface-tension   = 2.05016
   DispCorr             = No
   bSimTemp             = FALSE
   free-energy          = no
   nwall                = 0
   wall-type            = 9-3
   wall-atomtype[0]     = -1
   wall-atomtype[1]     = -1
   wall-density[0]      = 0
   wall-density[1]      = 0
   wall-ewald-zfac      = 3
   pull                 = no
   rotation             = FALSE
   disre                = No
   disre-weighting      = Conservative
   disre-mixed          = FALSE
   dr-fc                = 1000
   dr-tau               = 0
   nstdisreout          = 100
   orires-fc            = 0
   orires-tau           = 0
   nstorireout          = 100
   dihre-fc             = 0
   em-stepsize          = 0.01
   em-tol               = 10
   niter                = 20
   fc-stepsize          = 0
   nstcgsteep           = 1000
   nbfgscorr            = 10
   ConstAlg             = Lincs
   shake-tol            = 0.0001
   lincs-order          = 4
   lincs-warnangle      = 30
   lincs-iter           = 1
   bd-fric              = 0
   ld-seed              = 1993
   cos-accel            = 0
   deform (3x3):
      deform[    0]={ 0.00000e+00,  0.00000e+00,  0.00000e+00}
      deform[    1]={ 0.00000e+00,  0.00000e+00,  0.00000e+00}
      deform[    2]={ 0.00000e+00,  0.00000e+00,  0.00000e+00}
   adress               = FALSE
   userint1             = 0
   userint2             = 0
   userint3             = 0
   userint4             = 0
   userreal1            = 0
   userreal2            = 0
   userreal3            = 0
   userreal4            = 0
grpopts:
   nrdf:     12641.7      130503
   ref-t:         310         310
   tau-t:           2           2
anneal:          No          No
ann-npoints:           0           0
   acc:	           0           0           0
   nfreeze:           N           N           N
   energygrp-flags[  0]: 0
   efield-x:
      n = 0
   efield-xt:
      n = 0
   efield-y:
      n = 0
   efield-yt:
      n = 0
   efield-z:
      n = 0
   efield-zt:
      n = 0
   bQMMM                = FALSE
   QMconstraints        = 0
   QMMMscheme           = 0
   scalefactor          = 1
qm-opts:
   ngQM                 = 0
Detected 32 processors, will use this as the number of supported hardware threads.
hw_opt: nt 0 ntmpi 0 ntomp 1 ntomp_pme 1 gpu_id ''
in bc_data
in bc_data
in bc_data
after bc_inputrec
after bc_inputrec
after bc_symtab
after bc_symtab
after bc_name
after bc_name
after bc_name
after bc_atoms
after bc_atoms
after bc_atoms
after bc_atoms
after bc_atoms
after bc_atoms
after bc_atoms
after bc_atoms
after bc_atoms
after bc_atoms
after bc_atoms
after bc_atoms
after bc_atoms
after bc_ilists
after bc_ilists
after bc_molblock
after bc_molblock
after bc_molblock
after bc_molblock
after bc_molblock
after bc_molblock
after bc_molblock
after bc_molblock
after bc_groups
after bc_groups
after bc_groups
after bc_groups
graph part[] nchanged=748, bMultiPart=0
graph part[] nchanged=0, bMultiPart=0
graph part[] nchanged=748, bMultiPart=0
graph part[] nchanged=0, bMultiPart=0
graph part[] nchanged=748, bMultiPart=0
graph part[] nchanged=0, bMultiPart=0
graph part[] nchanged=748, bMultiPart=0
graph part[] nchanged=0, bMultiPart=0
graph part[] nchanged=748, bMultiPart=0
graph part[] nchanged=0, bMultiPart=0
graph part[] nchanged=748, bMultiPart=0
graph part[] nchanged=0, bMultiPart=0
Found longer constraint distance: r0 0.000 r1 0.260 rmax 0.260
 138 0.270
 138 0.270
 138 0.270
 138 0.270
 138 0.270
 138 0.270
 138 0.270
 138 0.270
 138 0.270
 138 0.270
 138 0.270
 138 0.270
 138 0.270
 138 0.270
 138 0.270
 138 0.270
box[0]  19.700 0.000 0.000
  v[1]  0.000 1.000 0.000
  v[2]  0.707 0.000 1.000
skew_fac[0] = 0.816496
normal[0]  0.667 0.000 -0.471
box[1]  0.000 19.700 0.000
  v[2]  0.000 0.707 1.000
skew_fac[1] = 0.816496
normal[1]  0.000 0.667 -0.471
ndx bonded 14984 exclusions 0
Average nr of pbc_dx calls per atom 0.31
nc  8  4  1  1  1 vol pp 1.2348 pbcdx 0.0312 pme 0.000e+00 tot 1.823e+05
nc  8  2  2  1  1 vol pp 1.3167 pbcdx 0.0000 pme 0.000e+00 tot 1.896e+05
nc  8  4  1  1  1 vol pp 1.2348 pbcdx 0.0312 pme 0.000e+00 tot 1.823e+05
nc  4  4  2  1  1 vol pp 1.1152 pbcdx 0.0000 pme 0.000e+00 tot 1.606e+05
nc  8  4  1  1  1 vol pp 1.2348 pbcdx 0.0312 pme 0.000e+00 tot 1.823e+05
nc  4  2  4  1  1 vol pp 1.1495 pbcdx 0.0000 pme 0.000e+00 tot 1.655e+05
nc  4  4  2  1  1 vol pp 1.1152 pbcdx 0.0000 pme 0.000e+00 tot 1.606e+05
nc  2  2  8  1  1 vol pp 1.4086 pbcdx 0.0000 pme 0.000e+00 tot 2.028e+05
nc  4  4  2  1  1 vol pp 1.1152 pbcdx 0.0000 pme 0.000e+00 tot 1.606e+05
Bonded atom communication beyond the cut-off: 0
cellsize limit 1.400000
Bonded atom communication beyond the cut-off: 0
cellsize limit 1.400000
Domain decomposition nodeid 30, coordinates 3 3 0

Bonded atom communication beyond the cut-off: 0
cellsize limit 1.400000
Bonded atom communication beyond the cut-off: 0
cellsize limit 1.400000
Bonded atom communication beyond the cut-off: 0
cellsize limit 1.400000
Bonded atom communication beyond the cut-off: 0
cellsize limit 1.400000
Bonded atom communication beyond the cut-off: 0
cellsize limit 1.400000
Bonded atom communication beyond the cut-off: 0
cellsize limit 1.400000
Bonded atom communication beyond the cut-off: 0
cellsize limit 1.400000
Bonded atom communication beyond the cut-off: 0
cellsize limit 1.400000
Bonded atom communication beyond the cut-off: 0
cellsize limit 1.400000
Bonded atom communication beyond the cut-off: 0
cellsize limit 1.400000
Domain decomposition nodeid 5, coordinates 0 2 1

Bonded atom communication beyond the cut-off: 0
cellsize limit 1.400000
Bonded atom communication beyond the cut-off: 0
cellsize limit 1.400000
Bonded atom communication beyond the cut-off: 0
cellsize limit 1.400000
Bonded atom communication beyond the cut-off: 0
cellsize limit 1.400000
Domain decomposition nodeid 2, coordinates 0 1 0

Bonded atom communication beyond the cut-off: 0
cellsize limit 1.400000
Domain decomposition nodeid 16, coordinates 2 0 0

Bonded atom communication beyond the cut-off: 0
cellsize limit 1.400000
Bonded atom communication beyond the cut-off: 0
cellsize limit 1.400000
Bonded atom communication beyond the cut-off: 0
cellsize limit 1.400000
Domain decomposition nodeid 12, coordinates 1 2 0

Bonded atom communication beyond the cut-off: 0
cellsize limit 1.400000
Bonded atom communication beyond the cut-off: 0
cellsize limit 1.400000
Bonded atom communication beyond the cut-off: 0
cellsize limit 1.400000
Bonded atom communication beyond the cut-off: 0
cellsize limit 1.400000
Bonded atom communication beyond the cut-off: 0
cellsize limit 1.400000
Domain decomposition nodeid 17, coordinates 2 0 1

Bonded atom communication beyond the cut-off: 0
cellsize limit 1.400000
Bonded atom communication beyond the cut-off: 0
cellsize limit 1.400000
Domain decomposition nodeid 4, coordinates 0 2 0

Bonded atom communication beyond the cut-off: 0
cellsize limit 1.400000
Bonded atom communication beyond the cut-off: 0
cellsize limit 1.400000
Domain decomposition nodeid 8, coordinates 1 0 0

Bonded atom communication beyond the cut-off: 0
cellsize limit 1.400000
Bonded atom communication beyond the cut-off: 0
cellsize limit 1.400000
Bonded atom communication beyond the cut-off: 0
cellsize limit 1.400000
On PP+PME node 30: nrank_intranode=32, rank_intranode=30, nrank_pp_intranode=32, rank_pp_intranode=30
Domain decomposition nodeid 31, coordinates 3 3 1

Domain decomposition nodeid 18, coordinates 2 1 0

Domain decomposition nodeid 11, coordinates 1 1 1

Domain decomposition nodeid 14, coordinates 1 3 0

On PP+PME node 5: nrank_intranode=32, rank_intranode=5, nrank_pp_intranode=32, rank_pp_intranode=5
Domain decomposition nodeid 24, coordinates 3 0 0

Domain decomposition nodeid 26, coordinates 3 1 0

Domain decomposition nodeid 1, coordinates 0 0 1

Domain decomposition nodeid 23, coordinates 2 3 1

On PP+PME node 2: nrank_intranode=32, rank_intranode=2, nrank_pp_intranode=32, rank_pp_intranode=2
Domain decomposition nodeid 22, coordinates 2 3 0

On PP+PME node 16: nrank_intranode=32, rank_intranode=16, nrank_pp_intranode=32, rank_pp_intranode=16
Domain decomposition nodeid 15, coordinates 1 3 1

Domain decomposition nodeid 7, coordinates 0 3 1

Domain decomposition nodeid 6, coordinates 0 3 0

On PP+PME node 12: nrank_intranode=32, rank_intranode=12, nrank_pp_intranode=32, rank_pp_intranode=12
Domain decomposition nodeid 29, coordinates 3 2 1

Domain decomposition nodeid 20, coordinates 2 2 0

Domain decomposition nodeid 13, coordinates 1 2 1

Domain decomposition nodeid 21, coordinates 2 2 1

Domain decomposition nodeid 3, coordinates 0 1 1

On PP+PME node 17: nrank_intranode=32, rank_intranode=17, nrank_pp_intranode=32, rank_pp_intranode=17
Domain decomposition nodeid 10, coordinates 1 1 0

Domain decomposition nodeid 27, coordinates 3 1 1

On PP+PME node 4: nrank_intranode=32, rank_intranode=4, nrank_pp_intranode=32, rank_pp_intranode=4
Domain decomposition nodeid 28, coordinates 3 2 0

Domain decomposition nodeid 9, coordinates 1 0 1

On PP+PME node 8: nrank_intranode=32, rank_intranode=8, nrank_pp_intranode=32, rank_pp_intranode=8
Domain decomposition nodeid 19, coordinates 2 1 1

Domain decomposition nodeid 25, coordinates 3 0 1

Domain decomposition nodeid 0, coordinates 0 0 0

On PP+PME node 31: nrank_intranode=32, rank_intranode=31, nrank_pp_intranode=32, rank_pp_intranode=31
On PP+PME node 18: nrank_intranode=32, rank_intranode=18, nrank_pp_intranode=32, rank_pp_intranode=18
On PP+PME node 11: nrank_intranode=32, rank_intranode=11, nrank_pp_intranode=32, rank_pp_intranode=11
On PP+PME node 14: nrank_intranode=32, rank_intranode=14, nrank_pp_intranode=32, rank_pp_intranode=14
On PP+PME node 24: nrank_intranode=32, rank_intranode=24, nrank_pp_intranode=32, rank_pp_intranode=24
On PP+PME node 26: nrank_intranode=32, rank_intranode=26, nrank_pp_intranode=32, rank_pp_intranode=26
On PP+PME node 1: nrank_intranode=32, rank_intranode=1, nrank_pp_intranode=32, rank_pp_intranode=1
On PP+PME node 23: nrank_intranode=32, rank_intranode=23, nrank_pp_intranode=32, rank_pp_intranode=23
On PP+PME node 22: nrank_intranode=32, rank_intranode=22, nrank_pp_intranode=32, rank_pp_intranode=22
On PP+PME node 15: nrank_intranode=32, rank_intranode=15, nrank_pp_intranode=32, rank_pp_intranode=15
On PP+PME node 7: nrank_intranode=32, rank_intranode=7, nrank_pp_intranode=32, rank_pp_intranode=7
On PP+PME node 6: nrank_intranode=32, rank_intranode=6, nrank_pp_intranode=32, rank_pp_intranode=6
On PP+PME node 29: nrank_intranode=32, rank_intranode=29, nrank_pp_intranode=32, rank_pp_intranode=29
On PP+PME node 20: nrank_intranode=32, rank_intranode=20, nrank_pp_intranode=32, rank_pp_intranode=20
On PP+PME node 13: nrank_intranode=32, rank_intranode=13, nrank_pp_intranode=32, rank_pp_intranode=13
On PP+PME node 21: nrank_intranode=32, rank_intranode=21, nrank_pp_intranode=32, rank_pp_intranode=21
On PP+PME node 3: nrank_intranode=32, rank_intranode=3, nrank_pp_intranode=32, rank_pp_intranode=3
On PP+PME node 10: nrank_intranode=32, rank_intranode=10, nrank_pp_intranode=32, rank_pp_intranode=10
On PP+PME node 27: nrank_intranode=32, rank_intranode=27, nrank_pp_intranode=32, rank_pp_intranode=27
On PP+PME node 28: nrank_intranode=32, rank_intranode=28, nrank_pp_intranode=32, rank_pp_intranode=28
On PP+PME node 9: nrank_intranode=32, rank_intranode=9, nrank_pp_intranode=32, rank_pp_intranode=9
On PP+PME node 19: nrank_intranode=32, rank_intranode=19, nrank_pp_intranode=32, rank_pp_intranode=19
On PP+PME node 25: nrank_intranode=32, rank_intranode=25, nrank_pp_intranode=32, rank_pp_intranode=25
On PP+PME node 0: nrank_intranode=32, rank_intranode=0, nrank_pp_intranode=32, rank_pp_intranode=0
Constants for short-range and fourier stuff:
r1 =      0.000,  rc =      1.200
A  = -2.411e+00,  B  =  1.608e+00,  C  =  1.389e+00, FourPi_V =  2.324e-03
c1 = -5.760e+01,  c2 =  7.200e+01,  c3 = -1.728e+01
c4 = -2.880e+01,  c5 = -7.200e+01,  c6 =  0.000e+00,  N0 =  1.876e+01
Constants for short-range and fourier stuff:
r1 =      0.000,  rc =      1.200
A  = -2.411e+00,  B  =  1.608e+00,  C  =  1.389e+00, FourPi_V =  2.324e-03
c1 = -5.760e+01,  c2 =  7.200e+01,  c3 = -1.728e+01
c4 = -2.880e+01,  c5 = -7.200e+01,  c6 =  0.000e+00,  N0 =  1.876e+01
Setting up tables
Constants for short-range and fourier stuff:
r1 =      0.000,  rc =      1.200
A  = -2.411e+00,  B  =  1.608e+00,  C  =  1.389e+00, FourPi_V =  2.324e-03
c1 = -5.760e+01,  c2 =  7.200e+01,  c3 = -1.728e+01
c4 = -2.880e+01,  c5 = -7.200e+01,  c6 =  0.000e+00,  N0 =  1.876e+01
Setting up tables
Setting up tables
Constants for short-range and fourier stuff:
r1 =      0.000,  rc =      1.200
A  = -2.411e+00,  B  =  1.608e+00,  C  =  1.389e+00, FourPi_V =  2.324e-03
c1 = -5.760e+01,  c2 =  7.200e+01,  c3 = -1.728e+01
c4 = -2.880e+01,  c5 = -7.200e+01,  c6 =  0.000e+00,  N0 =  1.876e+01
Setting up tables
Setting up tables
Setting up tables
Constants for short-range and fourier stuff:
r1 =      0.000,  rc =      1.200
A  = -2.411e+00,  B  =  1.608e+00,  C  =  1.389e+00, FourPi_V =  2.324e-03
c1 = -5.760e+01,  c2 =  7.200e+01,  c3 = -1.728e+01
c4 = -2.880e+01,  c5 = -7.200e+01,  c6 =  0.000e+00,  N0 =  1.876e+01
Setting up tables
Setting up tables
Setting up tables
Constants for short-range and fourier stuff:
r1 =      0.000,  rc =      1.200
A  = -2.411e+00,  B  =  1.608e+00,  C  =  1.389e+00, FourPi_V =  2.324e-03
c1 = -5.760e+01,  c2 =  7.200e+01,  c3 = -1.728e+01
c4 = -2.880e+01,  c5 = -7.200e+01,  c6 =  0.000e+00,  N0 =  1.876e+01
Setting up tables
Setting up tables
Setting up tables
Going to determine what solvent types we have.
Constants for short-range and fourier stuff:
r1 =      0.000,  rc =      1.200
A  = -2.411e+00,  B  =  1.608e+00,  C  =  1.389e+00, FourPi_V =  2.324e-03
Moltype 'NA+': there are 1 atoms in this charge group
c1 = -5.760e+01,  c2 =  7.200e+01,  c3 = -1.728e+01
c4 = -2.880e+01,  c5 = -7.200e+01,  c6 =  0.000e+00,  N0 =  1.876e+01
Moltype 'W': there are 1 atoms in this charge group
Setting up tables
Setting up tables
Setting up tables
Going to determine what solvent types we have.
Constants for short-range and fourier stuff:
r1 =      0.000,  rc =      1.200
A  = -2.411e+00,  B  =  1.608e+00,  C  =  1.389e+00, FourPi_V =  2.324e-03
The coordinates are bounded in 3 dimensions
Moltype 'NA+': there are 1 atoms in this charge group
Setting up tables
c1 = -5.760e+01,  c2 =  7.200e+01,  c3 = -1.728e+01
c4 = -2.880e+01,  c5 = -7.200e+01,  c6 =  0.000e+00,  N0 =  1.876e+01
Set ncg_ideal to 10
Moltype 'W': there are 1 atoms in this charge group
Setting up tables
Setting up tables
Going to determine what solvent types we have.
Constants for short-range and fourier stuff:
r1 =      0.000,  rc =      1.200
A  = -2.411e+00,  B  =  1.608e+00,  C  =  1.389e+00, FourPi_V =  2.324e-03
ns5_core: rs2 = 1.96, rm2 = 1.96, rl2 = 1.96 (nm^2)
Setting up tables
The coordinates are bounded in 3 dimensions
Moltype 'NA+': there are 1 atoms in this charge group
Setting up tables
c1 = -5.760e+01,  c2 =  7.200e+01,  c3 = -1.728e+01
c4 = -2.880e+01,  c5 = -7.200e+01,  c6 =  0.000e+00,  N0 =  1.876e+01
bHaveVdW (15):
Set ncg_ideal to 10
Setting up tables
Moltype 'W': there are 1 atoms in this charge group
Going to determine what solvent types we have.
Constants for short-range and fourier stuff:
r1 =      0.000,  rc =      1.200
A  = -2.411e+00,  B  =  1.608e+00,  C  =  1.389e+00, FourPi_V =  2.324e-03
 ns5_core: rs2 = 1.96, rm2 = 1.96, rl2 = 1.96 (nm^2)
Setting up tables
The coordinates are bounded in 3 dimensions
Setting up tables
Moltype 'NA+': there are 1 atoms in this charge group
Setting up tables
c1 = -5.760e+01,  c2 =  7.200e+01,  c3 = -1.728e+01
c4 = -2.880e+01,  c5 = -7.200e+01,  c6 =  0.000e+00,  N0 =  1.876e+01
 bHaveVdW (15):
Set ncg_ideal to 10
Moltype 'W': there are 1 atoms in this charge group
Going to determine what solvent types we have.
Constants for short-range and fourier stuff:
r1 =      0.000,  rc =      1.200
A  = -2.411e+00,  B  =  1.608e+00,  C  =  1.389e+00, FourPi_V =  2.324e-03
  ns5_core: rs2 = 1.96, rm2 = 1.96, rl2 = 1.96 (nm^2)
Setting up tables
Setting up tables
The coordinates are bounded in 3 dimensions
c1 = -5.760e+01,  c2 =  7.200e+01,  c3 = -1.728e+01
c4 = -2.880e+01,  c5 = -7.200e+01,  c6 =  0.000e+00,  N0 =  1.876e+01
Moltype 'NA+': there are 1 atoms in this charge group
Setting up tables
bHaveVdW[0]=TRUE
 Going to determine what solvent types we have.
bHaveVdW (15):
Set ncg_ideal to 10
Constants for short-range and fourier stuff:
r1 =      0.000,  rc =      1.200
A  = -2.411e+00,  B  =  1.608e+00,  C  =  1.389e+00, FourPi_V =  2.324e-03
Moltype 'W': there are 1 atoms in this charge group
   Moltype 'NA+': there are 1 atoms in this charge group
ns5_core: rs2 = 1.96, rm2 = 1.96, rl2 = 1.96 (nm^2)
Going to determine what solvent types we have.
Setting up tables
Setting up tables
c1 = -5.760e+01,  c2 =  7.200e+01,  c3 = -1.728e+01
c4 = -2.880e+01,  c5 = -7.200e+01,  c6 =  0.000e+00,  N0 =  1.876e+01
 The coordinates are bounded in 3 dimensions
bHaveVdW[0]=TRUE
 Setting up tables
Moltype 'W': there are 1 atoms in this charge group
bHaveVdW (15):
Moltype 'NA+': there are 1 atoms in this charge group
Constants for short-range and fourier stuff:
r1 =      0.000,  rc =      1.200
A  = -2.411e+00,  B  =  1.608e+00,  C  =  1.389e+00, FourPi_V =  2.324e-03
 Set ncg_ideal to 10
  Going to determine what solvent types we have.
 The coordinates are bounded in 3 dimensions
Moltype 'W': there are 1 atoms in this charge group
Setting up tables
Setting up tables
Setting up tables
c1 = -5.760e+01,  c2 =  7.200e+01,  c3 = -1.728e+01
c4 = -2.880e+01,  c5 = -7.200e+01,  c6 =  0.000e+00,  N0 =  1.876e+01
bHaveVdW[1]=TRUE
ns5_core: rs2 = 1.96, rm2 = 1.96, rl2 = 1.96 (nm^2)
 bHaveVdW[0]=TRUE
 Set ncg_ideal to 10
Moltype 'NA+': there are 1 atoms in this charge group
The coordinates are bounded in 3 dimensions
Constants for short-range and fourier stuff:
r1 =      0.000,  rc =      1.200
A  = -2.411e+00,  B  =  1.608e+00,  C  =  1.389e+00, FourPi_V =  2.324e-03
 bHaveVdW (15):
   ns5_core: rs2 = 1.96, rm2 = 1.96, rl2 = 1.96 (nm^2)
Moltype 'W': there are 1 atoms in this charge group
Setting up tables
Set ncg_ideal to 10
Setting up tables
Setting up tables
Going to determine what solvent types we have.
c1 = -5.760e+01,  c2 =  7.200e+01,  c3 = -1.728e+01
c4 = -2.880e+01,  c5 = -7.200e+01,  c6 =  0.000e+00,  N0 =  1.876e+01
  bHaveVdW[1]=TRUE
 bHaveVdW[0]=TRUE
bHaveVdW (15):
The coordinates are bounded in 3 dimensions
ns5_core: rs2 = 1.96, rm2 = 1.96, rl2 = 1.96 (nm^2)
Moltype 'NA+': there are 1 atoms in this charge group
Constants for short-range and fourier stuff:
r1 =      0.000,  rc =      1.200
A  = -2.411e+00,  B  =  1.608e+00,  C  =  1.389e+00, FourPi_V =  2.324e-03
   Going to determine what solvent types we have.
   Set ncg_ideal to 10
Setting up tables
bHaveVdW (15):
Setting up tables
Moltype 'W': there are 1 atoms in this charge group
Setting up tables
c1 = -5.760e+01,  c2 =  7.200e+01,  c3 = -1.728e+01
c4 = -2.880e+01,  c5 = -7.200e+01,  c6 =  0.000e+00,  N0 =  1.876e+01
bHaveVdW[2]=TRUE
  bHaveVdW[1]=TRUE
  Moltype 'NA+': there are 1 atoms in this charge group
ns5_core: rs2 = 1.96, rm2 = 1.96, rl2 = 1.96 (nm^2)
 The coordinates are bounded in 3 dimensions
Constants for short-range and fourier stuff:
r1 =      0.000,  rc =      1.200
A  = -2.411e+00,  B  =  1.608e+00,  C  =  1.389e+00, FourPi_V =  2.324e-03
 bHaveVdW[0]=TRUE
    Going to determine what solvent types we have.
Moltype 'W': there are 1 atoms in this charge group
Setting up tables
bHaveVdW (15):
Setting up tables
 Set ncg_ideal to 10
Setting up tables
c1 = -5.760e+01,  c2 =  7.200e+01,  c3 = -1.728e+01
c4 = -2.880e+01,  c5 = -7.200e+01,  c6 =  0.000e+00,  N0 =  1.876e+01
  bHaveVdW[2]=TRUE
 bHaveVdW[1]=TRUE
bHaveVdW[0]=TRUE
Moltype 'NA+': there are 1 atoms in this charge group
The coordinates are bounded in 3 dimensions
  ns5_core: rs2 = 1.96, rm2 = 1.96, rl2 = 1.96 (nm^2)
Constants for short-range and fourier stuff:
r1 =      0.000,  rc =      1.200
A  = -2.411e+00,  B  =  1.608e+00,  C  =  1.389e+00, FourPi_V =  2.324e-03
      Moltype 'W': there are 1 atoms in this charge group
Set ncg_ideal to 10
 Going to determine what solvent types we have.
bHaveVdW[0]=TRUE
Setting up tables
Setting up tables
bHaveVdW (15):
Setting up tables
c1 = -5.760e+01,  c2 =  7.200e+01,  c3 = -1.728e+01
c4 = -2.880e+01,  c5 = -7.200e+01,  c6 =  0.000e+00,  N0 =  1.876e+01
bHaveVdW[3]=TRUE
  bHaveVdW[2]=TRUE
   ns5_core: rs2 = 1.96, rm2 = 1.96, rl2 = 1.96 (nm^2)
The coordinates are bounded in 3 dimensions
 Moltype 'NA+': there are 1 atoms in this charge group
 Going to determine what solvent types we have.
Constants for short-range and fourier stuff:
r1 =      0.000,  rc =      1.200
A  = -2.411e+00,  B  =  1.608e+00,  C  =  1.389e+00, FourPi_V =  2.324e-03
 bHaveVdW[1]=TRUE
    bHaveVdW[0]=TRUE
bHaveVdW (15):
Set ncg_ideal to 10
 Setting up tables
Moltype 'W': there are 1 atoms in this charge group
 Moltype 'NA+': there are 1 atoms in this charge group
Setting up tables
Setting up tables
c1 = -5.760e+01,  c2 =  7.200e+01,  c3 = -1.728e+01
c4 = -2.880e+01,  c5 = -7.200e+01,  c6 =  0.000e+00,  N0 =  1.876e+01
  bHaveVdW[3]=TRUE
 bHaveVdW[2]=TRUE
bHaveVdW[1]=TRUE
   ns5_core: rs2 = 1.96, rm2 = 1.96, rl2 = 1.96 (nm^2)
 The coordinates are bounded in 3 dimensions
Moltype 'W': there are 1 atoms in this charge group
Constants for short-range and fourier stuff:
r1 =      0.000,  rc =      1.200
A  = -2.411e+00,  B  =  1.608e+00,  C  =  1.389e+00, FourPi_V =  2.324e-03
        bHaveVdW[1]=TRUE
Going to determine what solvent types we have.
Setting up tables
bHaveVdW (15):
bHaveVdW[0]=TRUE
Set ncg_ideal to 10
Setting up tables
The coordinates are bounded in 3 dimensions
Setting up tables
c1 = -5.760e+01,  c2 =  7.200e+01,  c3 = -1.728e+01
c4 = -2.880e+01,  c5 = -7.200e+01,  c6 =  0.000e+00,  N0 =  1.876e+01
bHaveVdW[4]=TRUE
  bHaveVdW[3]=TRUE
      Moltype 'NA+': there are 1 atoms in this charge group
 ns5_core: rs2 = 1.96, rm2 = 1.96, rl2 = 1.96 (nm^2)
Set ncg_ideal to 10
Going to determine what solvent types we have.
Constants for short-range and fourier stuff:
r1 =      0.000,  rc =      1.200
A  = -2.411e+00,  B  =  1.608e+00,  C  =  1.389e+00, FourPi_V =  2.324e-03
 bHaveVdW[2]=TRUE
    bHaveVdW[1]=TRUE
bHaveVdW[0]=TRUE
  Moltype 'W': there are 1 atoms in this charge group
 Setting up tables
Setting up tables
bHaveVdW (15):
ns5_core: rs2 = 1.96, rm2 = 1.96, rl2 = 1.96 (nm^2)
Setting up tables
Moltype 'NA+': there are 1 atoms in this charge group
c1 = -5.760e+01,  c2 =  7.200e+01,  c3 = -1.728e+01
c4 = -2.880e+01,  c5 = -7.200e+01,  c6 =  0.000e+00,  N0 =  1.876e+01
  bHaveVdW[4]=TRUE
 bHaveVdW[3]=TRUE
bHaveVdW[2]=TRUE
     The coordinates are bounded in 3 dimensions
 bHaveVdW (15):
Moltype 'W': there are 1 atoms in this charge group
Constants for short-range and fourier stuff:
r1 =      0.000,  rc =      1.200
A  = -2.411e+00,  B  =  1.608e+00,  C  =  1.389e+00, FourPi_V =  2.324e-03
 Going to determine what solvent types we have.
       bHaveVdW[2]=TRUE
bHaveVdW[0]=TRUE
bHaveVdW[1]=TRUE
Set ncg_ideal to 10
 Setting up tables
 Setting up tables
Setting up tables
The coordinates are bounded in 3 dimensions
c1 = -5.760e+01,  c2 =  7.200e+01,  c3 = -1.728e+01
c4 = -2.880e+01,  c5 = -7.200e+01,  c6 =  0.000e+00,  N0 =  1.876e+01
bHaveVdW[5]=TRUE
  bHaveVdW[4]=TRUE
Moltype 'NA+': there are 1 atoms in this charge group
        ns5_core: rs2 = 1.96, rm2 = 1.96, rl2 = 1.96 (nm^2)
 Set ncg_ideal to 10
Constants for short-range and fourier stuff:
r1 =      0.000,  rc =      1.200
A  = -2.411e+00,  B  =  1.608e+00,  C  =  1.389e+00, FourPi_V =  2.324e-03
 Going to determine what solvent types we have.
bHaveVdW[3]=TRUE
  Moltype 'W': there are 1 atoms in this charge group
  bHaveVdW[2]=TRUE
bHaveVdW[1]=TRUE
Setting up tables
   bHaveVdW[0]=TRUE
bHaveVdW (15):
 ns5_core: rs2 = 1.96, rm2 = 1.96, rl2 = 1.96 (nm^2)
Setting up tables
Setting up tables
c1 = -5.760e+01,  c2 =  7.200e+01,  c3 = -1.728e+01
c4 = -2.880e+01,  c5 = -7.200e+01,  c6 =  0.000e+00,  N0 =  1.876e+01
  Moltype 'NA+': there are 1 atoms in this charge group
bHaveVdW[5]=TRUE
 bHaveVdW[4]=TRUE
The coordinates are bounded in 3 dimensions
bHaveVdW[3]=TRUE
       bHaveVdW[0]=TRUE
bHaveVdW (15):
Going to determine what solvent types we have.
Constants for short-range and fourier stuff:
r1 =      0.000,  rc =      1.200
A  = -2.411e+00,  B  =  1.608e+00,  C  =  1.389e+00, FourPi_V =  2.324e-03
  Moltype 'W': there are 1 atoms in this charge group
   Set ncg_ideal to 10
   bHaveVdW[3]=TRUE
Setting up tables
bHaveVdW[1]=TRUE
bHaveVdW[2]=TRUE
 Setting up tables
   Moltype 'NA+': there are 1 atoms in this charge group
Setting up tables
c1 = -5.760e+01,  c2 =  7.200e+01,  c3 = -1.728e+01
c4 = -2.880e+01,  c5 = -7.200e+01,  c6 =  0.000e+00,  N0 =  1.876e+01
bHaveVdW[6]=TRUE
  bHaveVdW[5]=TRUE
The coordinates are bounded in 3 dimensions
 ns5_core: rs2 = 1.96, rm2 = 1.96, rl2 = 1.96 (nm^2)
          Moltype 'W': there are 1 atoms in this charge group
Constants for short-range and fourier stuff:
r1 =      0.000,  rc =      1.200
A  = -2.411e+00,  B  =  1.608e+00,  C  =  1.389e+00, FourPi_V =  2.324e-03
 bHaveVdW[4]=TRUE
  Going to determine what solvent types we have.
Set ncg_ideal to 10
 bHaveVdW (15):
 bHaveVdW[3]=TRUE
bHaveVdW[2]=TRUE
 Setting up tables
  bHaveVdW[1]=TRUE
bHaveVdW[0]=TRUE
 Setting up tables
 Setting up tables
The coordinates are bounded in 3 dimensions
c1 = -5.760e+01,  c2 =  7.200e+01,  c3 = -1.728e+01
c4 = -2.880e+01,  c5 = -7.200e+01,  c6 =  0.000e+00,  N0 =  1.876e+01
  bHaveVdW[6]=TRUE
 bHaveVdW[5]=TRUE
ns5_core: rs2 = 1.96, rm2 = 1.96, rl2 = 1.96 (nm^2)
 Moltype 'NA+': there are 1 atoms in this charge group
bHaveVdW[4]=TRUE
       bHaveVdW[1]=TRUE
bHaveVdW[0]=TRUE
Set ncg_ideal to 10
Going to determine what solvent types we have.
Constants for short-range and fourier stuff:
r1 =      0.000,  rc =      1.200
A  = -2.411e+00,  B  =  1.608e+00,  C  =  1.389e+00, FourPi_V =  2.324e-03
     bHaveVdW (15):
 Moltype 'W': there are 1 atoms in this charge group
 Setting up tables
  bHaveVdW[4]=TRUE
bHaveVdW[2]=TRUE
bHaveVdW[3]=TRUE
   Setting up tables
 ns5_core: rs2 = 1.96, rm2 = 1.96, rl2 = 1.96 (nm^2)
Setting up tables
Moltype 'NA+': there are 1 atoms in this charge group
c1 = -5.760e+01,  c2 =  7.200e+01,  c3 = -1.728e+01
c4 = -2.880e+01,  c5 = -7.200e+01,  c6 =  0.000e+00,  N0 =  1.876e+01
bHaveVdW[7]=TRUE
  bHaveVdW[6]=TRUE
    The coordinates are bounded in 3 dimensions
         bHaveVdW (15):
Moltype 'W': there are 1 atoms in this charge group
Going to determine what solvent types we have.
Constants for short-range and fourier stuff:
r1 =      0.000,  rc =      1.200
A  = -2.411e+00,  B  =  1.608e+00,  C  =  1.389e+00, FourPi_V =  2.324e-03
 bHaveVdW[5]=TRUE
    bHaveVdW[0]=TRUE
 Set ncg_ideal to 10
bHaveVdW[4]=TRUE
bHaveVdW[3]=TRUE
   bHaveVdW[2]=TRUE
bHaveVdW[1]=TRUE
 Setting up tables
 Setting up tables
 Setting up tables
The coordinates are bounded in 3 dimensions
Moltype 'NA+': there are 1 atoms in this charge group
c1 = -5.760e+01,  c2 =  7.200e+01,  c3 = -1.728e+01
c4 = -2.880e+01,  c5 = -7.200e+01,  c6 =  0.000e+00,  N0 =  1.876e+01
  bHaveVdW[7]=TRUE
 bHaveVdW[6]=TRUE
  bHaveVdW[5]=TRUE
ns5_core: rs2 = 1.96, rm2 = 1.96, rl2 = 1.96 (nm^2)
       bHaveVdW[2]=TRUE
bHaveVdW[1]=TRUE
 Set ncg_ideal to 10
Moltype 'W': there are 1 atoms in this charge group
 Constants for short-range and fourier stuff:
r1 =      0.000,  rc =      1.200
A  = -2.411e+00,  B  =  1.608e+00,  C  =  1.389e+00, FourPi_V =  2.324e-03
   Going to determine what solvent types we have.
 bHaveVdW[0]=TRUE
  Setting up tables
bHaveVdW (15):
  bHaveVdW[5]=TRUE
bHaveVdW[3]=TRUE
bHaveVdW[4]=TRUE
     Setting up tables
ns5_core: rs2 = 1.96, rm2 = 1.96, rl2 = 1.96 (nm^2)
Setting up tables
bHaveVdW[8]=TRUE
The coordinates are bounded in 3 dimensions
c1 = -5.760e+01,  c2 =  7.200e+01,  c3 = -1.728e+01
c4 = -2.880e+01,  c5 = -7.200e+01,  c6 =  0.000e+00,  N0 =  1.876e+01
  bHaveVdW[7]=TRUE
   Moltype 'NA+': there are 1 atoms in this charge group
           bHaveVdW[0]=TRUE
bHaveVdW (15):
 Set ncg_ideal to 10
bHaveVdW[6]=TRUE
Constants for short-range and fourier stuff:
r1 =      0.000,  rc =      1.200
A  = -2.411e+00,  B  =  1.608e+00,  C  =  1.389e+00, FourPi_V =  2.324e-03
    bHaveVdW[1]=TRUE
Moltype 'W': there are 1 atoms in this charge group
  bHaveVdW[5]=TRUE
bHaveVdW[4]=TRUE
  Setting up tables
 bHaveVdW[3]=TRUE
bHaveVdW[2]=TRUE
Setting up tables
   Going to determine what solvent types we have.
  ns5_core: rs2 = 1.96, rm2 = 1.96, rl2 = 1.96 (nm^2)
 Setting up tables
c1 = -5.760e+01,  c2 =  7.200e+01,  c3 = -1.728e+01
c4 = -2.880e+01,  c5 = -7.200e+01,  c6 =  0.000e+00,  N0 =  1.876e+01
bHaveVdW[8]=TRUE
 bHaveVdW[7]=TRUE
  bHaveVdW[6]=TRUE
 The coordinates are bounded in 3 dimensions
       bHaveVdW[3]=TRUE
bHaveVdW[2]=TRUE
   Moltype 'NA+': there are 1 atoms in this charge group
Going to determine what solvent types we have.
bHaveVdW (15):
 Constants for short-range and fourier stuff:
r1 =      0.000,  rc =      1.200
A  = -2.411e+00,  B  =  1.608e+00,  C  =  1.389e+00, FourPi_V =  2.324e-03
   bHaveVdW[1]=TRUE
  bHaveVdW[0]=TRUE
Set ncg_ideal to 10
  Setting up tables
bHaveVdW[6]=TRUE
bHaveVdW[4]=TRUE
bHaveVdW[5]=TRUE
   Setting up tables
  Setting up tables
 bHaveVdW[9]=TRUE
Moltype 'W': there are 1 atoms in this charge group
  Moltype 'NA+': there are 1 atoms in this charge group
c1 = -5.760e+01,  c2 =  7.200e+01,  c3 = -1.728e+01
c4 = -2.880e+01,  c5 = -7.200e+01,  c6 =  0.000e+00,  N0 =  1.876e+01
 bHaveVdW[8]=TRUE
     ns5_core: rs2 = 1.96, rm2 = 1.96, rl2 = 1.96 (nm^2)
         bHaveVdW[1]=TRUE
bHaveVdW[0]=TRUE
  bHaveVdW[7]=TRUE
The coordinates are bounded in 3 dimensions
Moltype 'W': there are 1 atoms in this charge group
Constants for short-range and fourier stuff:
r1 =      0.000,  rc =      1.200
A  = -2.411e+00,  B  =  1.608e+00,  C  =  1.389e+00, FourPi_V =  2.324e-03
 Going to determine what solvent types we have.
   bHaveVdW[2]=TRUE
  bHaveVdW (15):
bHaveVdW[6]=TRUE
bHaveVdW[5]=TRUE
  Setting up tables
 bHaveVdW[4]=TRUE
bHaveVdW[3]=TRUE
 Setting up tables
     Setting up tables
 Set ncg_ideal to 10
The coordinates are bounded in 3 dimensions
c1 = -5.760e+01,  c2 =  7.200e+01,  c3 = -1.728e+01
c4 = -2.880e+01,  c5 = -7.200e+01,  c6 =  0.000e+00,  N0 =  1.876e+01
bHaveVdW[9]=TRUE
 bHaveVdW[8]=TRUE
 Moltype 'NA+': there are 1 atoms in this charge group
 bHaveVdW[7]=TRUE
         bHaveVdW[4]=TRUE
bHaveVdW[3]=TRUE
   bHaveVdW[0]=TRUE
 ns5_core: rs2 = 1.96, rm2 = 1.96, rl2 = 1.96 (nm^2)
Set ncg_ideal to 10
Going to determine what solvent types we have.
Constants for short-range and fourier stuff:
r1 =      0.000,  rc =      1.200
A  = -2.411e+00,  B  =  1.608e+00,  C  =  1.389e+00, FourPi_V =  2.324e-03
   bHaveVdW[2]=TRUE
Moltype 'W': there are 1 atoms in this charge group
  bHaveVdW[1]=TRUE
   bHaveVdW[7]=TRUE
bHaveVdW[5]=TRUE
bHaveVdW[6]=TRUE
Setting up tables
   Setting up tables
   bHaveVdW[10]=TRUE
Setting up tables
  bHaveVdW (15):
ns5_core: rs2 = 1.96, rm2 = 1.96, rl2 = 1.96 (nm^2)
Moltype 'NA+': there are 1 atoms in this charge group
c1 = -5.760e+01,  c2 =  7.200e+01,  c3 = -1.728e+01
c4 = -2.880e+01,  c5 = -7.200e+01,  c6 =  0.000e+00,  N0 =  1.876e+01
 bHaveVdW[9]=TRUE
    The coordinates are bounded in 3 dimensions
           bHaveVdW[2]=TRUE
bHaveVdW[1]=TRUE
  bHaveVdW[8]=TRUE
 bHaveVdW (15):
Going to determine what solvent types we have.
Moltype 'W': there are 1 atoms in this charge group
Constants for short-range and fourier stuff:
r1 =      0.000,  rc =      1.200
A  = -2.411e+00,  B  =  1.608e+00,  C  =  1.389e+00, FourPi_V =  2.324e-03
    bHaveVdW[3]=TRUE
 Set ncg_ideal to 10
 bHaveVdW[0]=TRUE
bHaveVdW[7]=TRUE
bHaveVdW[6]=TRUE
   bHaveVdW[5]=TRUE
bHaveVdW[4]=TRUE
 Setting up tables
 Setting up tables
 Setting up tables
      Moltype 'NA+': there are 1 atoms in this charge group
The coordinates are bounded in 3 dimensions
c1 = -5.760e+01,  c2 =  7.200e+01,  c3 = -1.728e+01
c4 = -2.880e+01,  c5 = -7.200e+01,  c6 =  0.000e+00,  N0 =  1.876e+01
bHaveVdW[10]=TRUE
 bHaveVdW[9]=TRUE
  bHaveVdW[8]=TRUE
 ns5_core: rs2 = 1.96, rm2 = 1.96, rl2 = 1.96 (nm^2)
        bHaveVdW[5]=TRUE
bHaveVdW[4]=TRUE
   bHaveVdW[1]=TRUE
   Moltype 'W': there are 1 atoms in this charge group
Set ncg_ideal to 10
Going to determine what solvent types we have.
   bHaveVdW[3]=TRUE
  bHaveVdW[2]=TRUE
bHaveVdW (15):
   bHaveVdW[8]=TRUE
bHaveVdW[6]=TRUE
bHaveVdW[7]=TRUE
     Setting up tables
 bHaveVdW[11]=TRUE
Setting up tables
Setting up tables
  bHaveVdW[0]=TRUE
 The coordinates are bounded in 3 dimensions
 bHaveVdW[10]=TRUE
 ns5_core: rs2 = 1.96, rm2 = 1.96, rl2 = 1.96 (nm^2)
   Moltype 'NA+': there are 1 atoms in this charge group
            bHaveVdW[3]=TRUE
bHaveVdW[2]=TRUE
  bHaveVdW[9]=TRUE
 bHaveVdW[0]=TRUE
Set ncg_ideal to 10
   bHaveVdW (15):
 bHaveVdW[4]=TRUE
 Moltype 'W': there are 1 atoms in this charge group
Going to determine what solvent types we have.
  bHaveVdW[1]=TRUE
bHaveVdW[8]=TRUE
bHaveVdW[7]=TRUE
   bHaveVdW[6]=TRUE
bHaveVdW[5]=TRUE
       Setting up tables
  ns5_core: rs2 = 1.96, rm2 = 1.96, rl2 = 1.96 (nm^2)
bHaveVdW[11]=TRUE
 bHaveVdW[10]=TRUE
   bHaveVdW[9]=TRUE
The coordinates are bounded in 3 dimensions
  Moltype 'NA+': there are 1 atoms in this charge group
        bHaveVdW[6]=TRUE
bHaveVdW[5]=TRUE
   bHaveVdW[2]=TRUE
   bHaveVdW (15):
  Going to determine what solvent types we have.
  bHaveVdW[4]=TRUE
  Set ncg_ideal to 10
bHaveVdW[3]=TRUE
bHaveVdW[0]=TRUE
Moltype 'W': there are 1 atoms in this charge group
   bHaveVdW[9]=TRUE
bHaveVdW[7]=TRUE
bHaveVdW[8]=TRUE
      bHaveVdW[12]=TRUE
  bHaveVdW[1]=TRUE
   bHaveVdW[11]=TRUE
    Moltype 'NA+': there are 1 atoms in this charge group
 ns5_core: rs2 = 1.96, rm2 = 1.96, rl2 = 1.96 (nm^2)
    The coordinates are bounded in 3 dimensions
        bHaveVdW[4]=TRUE
bHaveVdW[3]=TRUE
  bHaveVdW[10]=TRUE
 bHaveVdW[1]=TRUE
    bHaveVdW[0]=TRUE
 bHaveVdW[5]=TRUE
Moltype 'W': there are 1 atoms in this charge group
 Going to determine what solvent types we have.
bHaveVdW (15):
  bHaveVdW[2]=TRUE
bHaveVdW[9]=TRUE
Set ncg_ideal to 10
bHaveVdW[8]=TRUE
   bHaveVdW[7]=TRUE
bHaveVdW[6]=TRUE
          bHaveVdW[12]=TRUE
 bHaveVdW[11]=TRUE
   bHaveVdW[10]=TRUE
The coordinates are bounded in 3 dimensions
   Moltype 'NA+': there are 1 atoms in this charge group
  ns5_core: rs2 = 1.96, rm2 = 1.96, rl2 = 1.96 (nm^2)
      bHaveVdW[7]=TRUE
bHaveVdW[6]=TRUE
   bHaveVdW[3]=TRUE
   bHaveVdW[0]=TRUE
    bHaveVdW[5]=TRUE
  Set ncg_ideal to 10
 bHaveVdW[4]=TRUE
bHaveVdW[1]=TRUE
Moltype 'W': there are 1 atoms in this charge group
  bHaveVdW (15):
 bHaveVdW[10]=TRUE
bHaveVdW[8]=TRUE
bHaveVdW[9]=TRUE
      bHaveVdW[13]=TRUE
  bHaveVdW[2]=TRUE
   bHaveVdW[12]=TRUE
     ns5_core: rs2 = 1.96, rm2 = 1.96, rl2 = 1.96 (nm^2)
     The coordinates are bounded in 3 dimensions
         bHaveVdW[5]=TRUE
bHaveVdW[4]=TRUE
  bHaveVdW[11]=TRUE
 bHaveVdW[2]=TRUE
    bHaveVdW[1]=TRUE
 bHaveVdW[6]=TRUE
 bHaveVdW (15):
bHaveVdW[0]=TRUE
  bHaveVdW[3]=TRUE
bHaveVdW[10]=TRUE
Set ncg_ideal to 10
 bHaveVdW[9]=TRUE
   bHaveVdW[8]=TRUE
bHaveVdW[7]=TRUE
          bHaveVdW[13]=TRUE
 bHaveVdW[12]=TRUE
   bHaveVdW[11]=TRUE
      ns5_core: rs2 = 1.96, rm2 = 1.96, rl2 = 1.96 (nm^2)
       bHaveVdW[8]=TRUE
bHaveVdW[7]=TRUE
   bHaveVdW[4]=TRUE
   bHaveVdW[1]=TRUE
    bHaveVdW[6]=TRUE
    bHaveVdW[5]=TRUE
bHaveVdW[2]=TRUE
  bHaveVdW (15):
bHaveVdW[0]=TRUE
 bHaveVdW[11]=TRUE
bHaveVdW[9]=TRUE
bHaveVdW[10]=TRUE
      bHaveVdW[14]=TRUE
  bHaveVdW[3]=TRUE
   bHaveVdW[13]=TRUE
        Opening library file /usr/local/gromacs/share/gromacs/top/bromacs.dat
             bHaveVdW[6]=TRUE
bHaveVdW[5]=TRUE
 bHaveVdW[12]=TRUE
 bHaveVdW[3]=TRUE
    bHaveVdW[2]=TRUE
 bHaveVdW[7]=TRUE
 bHaveVdW[0]=TRUE
bHaveVdW[1]=TRUE
  bHaveVdW[4]=TRUE
bHaveVdW[11]=TRUE
  bHaveVdW[10]=TRUE
   bHaveVdW[9]=TRUE
bHaveVdW[8]=TRUE
         bHaveVdW[14]=TRUE
 bHaveVdW[13]=TRUE
   bHaveVdW[12]=TRUE
              bHaveVdW[9]=TRUE
bHaveVdW[8]=TRUE
  bHaveVdW[5]=TRUE
   bHaveVdW[2]=TRUE
   bHaveVdW[7]=TRUE
    bHaveVdW[6]=TRUE
bHaveVdW[3]=TRUE
  bHaveVdW[0]=TRUE
bHaveVdW[1]=TRUE
 bHaveVdW[12]=TRUE
bHaveVdW[10]=TRUE
bHaveVdW[11]=TRUE
        bHaveVdW[4]=TRUE
 Installing signal handler for SIGTERM
 bHaveVdW[14]=TRUE
                     bHaveVdW[7]=TRUE
bHaveVdW[6]=TRUE
 Installing signal handler for SIGTERM
bHaveVdW[13]=TRUE
 bHaveVdW[4]=TRUE
Installing signal handler for SIGINT
  bHaveVdW[3]=TRUE
 bHaveVdW[8]=TRUE
 bHaveVdW[1]=TRUE
bHaveVdW[2]=TRUE
  bHaveVdW[5]=TRUE
bHaveVdW[12]=TRUE
  bHaveVdW[11]=TRUE
   bHaveVdW[10]=TRUE
bHaveVdW[9]=TRUE
     Installing signal handler for SIGINT
   Installing signal handler for SIGUSR1
 bHaveVdW[14]=TRUE
   bHaveVdW[13]=TRUE
              bHaveVdW[10]=TRUE
bHaveVdW[9]=TRUE
  bHaveVdW[6]=TRUE
Installing signal handler for SIGUSR1
 Installing signal handler for SIGTERM
  bHaveVdW[3]=TRUE
 bHaveVdW[8]=TRUE
    bHaveVdW[7]=TRUE
bHaveVdW[4]=TRUE
PLINCS communication before each iteration: 1
  bHaveVdW[1]=TRUE
bHaveVdW[2]=TRUE
 bHaveVdW[13]=TRUE
bHaveVdW[11]=TRUE
bHaveVdW[12]=TRUE
        Installing signal handler for SIGINT
bHaveVdW[5]=TRUE
   PLINCS communication before each iteration: 1
       LINCS: using 1 threads
            bHaveVdW[8]=TRUE
bHaveVdW[7]=TRUE
 bHaveVdW[14]=TRUE
Installing signal handler for SIGUSR1
 bHaveVdW[5]=TRUE
 bHaveVdW[4]=TRUE
Installing signal handler for SIGTERM
LINCS: using 1 threads
 bHaveVdW[9]=TRUE
 bHaveVdW[2]=TRUE
bHaveVdW[3]=TRUE
  bHaveVdW[6]=TRUE
bHaveVdW[13]=TRUE
  bHaveVdW[12]=TRUE
   bHaveVdW[11]=TRUE
bHaveVdW[10]=TRUE
         Installing signal handler for SIGINT
  bHaveVdW[14]=TRUE
     PLINCS communication before each iteration: 1
    The total size of the atom to interaction index is 42398 integers
     bHaveVdW[11]=TRUE
bHaveVdW[10]=TRUE
  bHaveVdW[7]=TRUE
  bHaveVdW[4]=TRUE
 Installing signal handler for SIGUSR1
bHaveVdW[9]=TRUE
   bHaveVdW[8]=TRUE
bHaveVdW[5]=TRUE
 The total size of the atom to interaction index is 42398 integers
LINCS: using 1 threads
 bHaveVdW[2]=TRUE
bHaveVdW[3]=TRUE
Installing signal handler for SIGTERM
 bHaveVdW[14]=TRUE
bHaveVdW[12]=TRUE
bHaveVdW[13]=TRUE
   Begin init_domdec_constraints
    bHaveVdW[6]=TRUE
        PLINCS communication before each iteration: 1
     Begin init_domdec_constraints
Installing signal handler for SIGINT
       bHaveVdW[9]=TRUE
bHaveVdW[8]=TRUE
 Hash table mod 2048 nalloc 2537
 bHaveVdW[6]=TRUE
Installing signal handler for SIGTERM
 bHaveVdW[5]=TRUE
 bHaveVdW[10]=TRUE
bHaveVdW[3]=TRUE
bHaveVdW[4]=TRUE
 LINCS: using 1 threads
 bHaveVdW[7]=TRUE
bHaveVdW[14]=TRUE
  Installing signal handler for SIGUSR1
bHaveVdW[13]=TRUE
Hash table mod 2048 nalloc 2537
  The total size of the atom to interaction index is 42398 integers
bHaveVdW[12]=TRUE
bHaveVdW[11]=TRUE
      The DD cut-off is 1.400000
 Installing signal handler for SIGINT
           Installing signal handler for SIGTERM
   The DD cut-off is 1.400000
  bHaveVdW[12]=TRUE
bHaveVdW[11]=TRUE
  bHaveVdW[8]=TRUE
 PLINCS communication before each iteration: 1
Begin init_domdec_constraints
 Volume fraction for all DD zones: 0.066099
Installing signal handler for SIGUSR1
bHaveVdW[5]=TRUE
 bHaveVdW[10]=TRUE
   bHaveVdW[9]=TRUE
bHaveVdW[6]=TRUE
 bHaveVdW[3]=TRUE
bHaveVdW[4]=TRUE
Installing signal handler for SIGINT
 bHaveVdW[13]=TRUE
bHaveVdW[14]=TRUE
The total size of the atom to interaction index is 42398 integers
Volume fraction for all DD zones: 0.066099
       bHaveVdW[7]=TRUE
LINCS: using 1 threads
Hash table mod 2048 nalloc 2537
 Installing signal handler for SIGTERM
    DD rank 15 neighbor ranks in dir 0 are + 23 - 7
       Installing signal handler for SIGUSR1
      bHaveVdW[10]=TRUE
bHaveVdW[9]=TRUE
  bHaveVdW[7]=TRUE
DD rank 29 neighbor ranks in dir 0 are + 5 - 21
Installing signal handler for SIGINT
 bHaveVdW[6]=TRUE
 bHaveVdW[11]=TRUE
The DD cut-off is 1.400000
DD rank 15 neighbor ranks in dir 1 are + 9 - 13
bHaveVdW[4]=TRUE
bHaveVdW[5]=TRUE
PLINCS communication before each iteration: 1
  Begin init_domdec_constraints
bHaveVdW[8]=TRUE
  bHaveVdW[14]=TRUE
 bHaveVdW[13]=TRUE
bHaveVdW[12]=TRUE
   PLINCS communication before each iteration: 1
    DD rank 29 neighbor ranks in dir 1 are + 31 - 27
Installing signal handler for SIGUSR1
    Volume fraction for all DD zones: 0.066099
DD rank 15 neighbor ranks in dir 2 are + 14 - 14
  LINCS: using 1 threads
     Hash table mod 2048 nalloc 2537
 The total size of the atom to interaction index is 42398 integers
  bHaveVdW[13]=TRUE
bHaveVdW[12]=TRUE
 LINCS: using 1 threads
 bHaveVdW[9]=TRUE
  DD rank 29 neighbor ranks in dir 2 are + 28 - 28
bHaveVdW[6]=TRUE
 bHaveVdW[11]=TRUE
 PLINCS communication before each iteration: 1
  Making load communicators
DD rank 22 neighbor ranks in dir 0 are + 30 - 14
bHaveVdW[10]=TRUE
bHaveVdW[7]=TRUE
 bHaveVdW[4]=TRUE
bHaveVdW[5]=TRUE
Installing signal handler for SIGTERM
bHaveVdW[14]=TRUE
The DD cut-off is 1.400000
    Begin init_domdec_constraints
   bHaveVdW[8]=TRUE
 Making load communicators
    Installing signal handler for SIGTERM
LINCS: using 1 threads
  DD rank 22 neighbor ranks in dir 1 are + 16 - 20
   The total size of the atom to interaction index is 42398 integers
  Installing signal handler for SIGINT
Volume fraction for all DD zones: 0.066099
    bHaveVdW[11]=TRUE
bHaveVdW[10]=TRUE
 Hash table mod 2048 nalloc 2537
The total size of the atom to interaction index is 42398 integers
 bHaveVdW[8]=TRUE
 bHaveVdW[7]=TRUE
 bHaveVdW[12]=TRUE
Installing signal handler for SIGINT
bHaveVdW[5]=TRUE
bHaveVdW[6]=TRUE
DD rank 22 neighbor ranks in dir 2 are + 23 - 23
  bHaveVdW[9]=TRUE
  Installing signal handler for SIGUSR1
bHaveVdW[14]=TRUE
Begin init_domdec_constraints
bHaveVdW[13]=TRUE
       DD rank 21 neighbor ranks in dir 0 are + 29 - 13
    Installing signal handler for SIGUSR1
The DD cut-off is 1.400000
  Installing signal handler for SIGTERM
Begin init_domdec_constraints
  Making load communicators
    bHaveVdW[14]=TRUE
bHaveVdW[13]=TRUE
  bHaveVdW[10]=TRUE
  Hash table mod 2048 nalloc 2537
DD rank 21 neighbor ranks in dir 1 are + 23 - 19
bHaveVdW[7]=TRUE
 bHaveVdW[12]=TRUE
   Installing signal handler for SIGINT
Volume fraction for all DD zones: 0.066099
bHaveVdW[11]=TRUE
bHaveVdW[8]=TRUE
 bHaveVdW[5]=TRUE
bHaveVdW[6]=TRUE
 The total size of the atom to interaction index is 42398 integers
 Hash table mod 2048 nalloc 2537
   bHaveVdW[9]=TRUE
 DD rank 21 neighbor ranks in dir 2 are + 20 - 20
  The DD cut-off is 1.400000
    Installing signal handler for SIGUSR1
       DD rank 17 neighbor ranks in dir 0 are + 25 - 9
bHaveVdW[12]=TRUE
bHaveVdW[11]=TRUE
  bHaveVdW[9]=TRUE
The DD cut-off is 1.400000
 bHaveVdW[8]=TRUE
Making load communicators
PLINCS communication before each iteration: 1
 bHaveVdW[13]=TRUE
Begin init_domdec_constraints
bHaveVdW[6]=TRUE
Volume fraction for all DD zones: 0.066099
bHaveVdW[7]=TRUE
  bHaveVdW[10]=TRUE
PLINCS communication before each iteration: 1
  Installing signal handler for SIGTERM
bHaveVdW[14]=TRUE
 DD rank 17 neighbor ranks in dir 1 are + 19 - 23
 PLINCS communication before each iteration: 1
    Installing signal handler for SIGTERM
Volume fraction for all DD zones: 0.066099
  LINCS: using 1 threads
  Hash table mod 2048 nalloc 2537
       Installing signal handler for SIGINT
bHaveVdW[14]=TRUE
LINCS: using 1 threads
DD rank 2 neighbor ranks in dir 0 are + 10 - 26
DD rank 17 neighbor ranks in dir 2 are + 16 - 16
 LINCS: using 1 threads
 bHaveVdW[11]=TRUE
  Installing signal handler for SIGINT
bHaveVdW[8]=TRUE
 bHaveVdW[13]=TRUE
   bHaveVdW[12]=TRUE
DD rank 7 neighbor ranks in dir 0 are + 15 - 31
bHaveVdW[9]=TRUE
 The DD cut-off is 1.400000
bHaveVdW[6]=TRUE
bHaveVdW[7]=TRUE
Installing signal handler for SIGUSR1
DD rank 2 neighbor ranks in dir 1 are + 4 - 0
 Making load communicators
  bHaveVdW[10]=TRUE
 Installing signal handler for SIGUSR1
       DD rank 7 neighbor ranks in dir 1 are + 1 - 5
    Installing signal handler for SIGTERM
DD rank 2 neighbor ranks in dir 2 are + 3 - 3
bHaveVdW[13]=TRUE
bHaveVdW[12]=TRUE
  bHaveVdW[10]=TRUE
 Volume fraction for all DD zones: 0.066099
bHaveVdW[9]=TRUE
 bHaveVdW[14]=TRUE
bHaveVdW[7]=TRUE
bHaveVdW[8]=TRUE
 DD rank 7 neighbor ranks in dir 2 are + 6 - 6
 bHaveVdW[11]=TRUE
  Installing signal handler for SIGINT
      Making load communicators
     DD rank 6 neighbor ranks in dir 0 are + 14 - 30
   Making load communicators
 Installing signal handler for SIGUSR1
  bHaveVdW[12]=TRUE
  bHaveVdW[9]=TRUE
 bHaveVdW[14]=TRUE
  bHaveVdW[13]=TRUE
DD rank 6 neighbor ranks in dir 1 are + 0 - 4
bHaveVdW[10]=TRUE
 bHaveVdW[7]=TRUE
bHaveVdW[8]=TRUE
The total size of the atom to interaction index is 42398 integers
   bHaveVdW[11]=TRUE
      DD rank 6 neighbor ranks in dir 2 are + 7 - 7
Installing signal handler for SIGTERM
  The total size of the atom to interaction index is 42398 integers
  bHaveVdW[14]=TRUE
bHaveVdW[13]=TRUE
  bHaveVdW[11]=TRUE
The total size of the atom to interaction index is 42398 integers
 bHaveVdW[10]=TRUE
bHaveVdW[8]=TRUE
bHaveVdW[9]=TRUE
 Making load communicators
Installing signal handler for SIGINT
 bHaveVdW[12]=TRUE
Begin init_domdec_constraints
  PLINCS communication before each iteration: 1
  PLINCS communication before each iteration: 1
  PLINCS communication before each iteration: 1
 Begin init_domdec_constraints
  Begin init_domdec_constraints
  Installing signal handler for SIGUSR1
    Hash table mod 2048 nalloc 2537
LINCS: using 1 threads
 Installing signal handler for SIGTERM
bHaveVdW[13]=TRUE
LINCS: using 1 threads
  LINCS: using 1 threads
bHaveVdW[10]=TRUE
 Hash table mod 2048 nalloc 2537
 Hash table mod 2048 nalloc 2537
 bHaveVdW[14]=TRUE
bHaveVdW[11]=TRUE
 bHaveVdW[8]=TRUE
bHaveVdW[9]=TRUE
PLINCS communication before each iteration: 1
The DD cut-off is 1.400000
 Installing signal handler for SIGINT
 bHaveVdW[12]=TRUE
         bHaveVdW[14]=TRUE
Installing signal handler for SIGUSR1
  LINCS: using 1 threads
bHaveVdW[12]=TRUE
 bHaveVdW[11]=TRUE
bHaveVdW[9]=TRUE
bHaveVdW[10]=TRUE
 bHaveVdW[13]=TRUE
 The DD cut-off is 1.400000
 The DD cut-off is 1.400000
Volume fraction for all DD zones: 0.066099
           bHaveVdW[14]=TRUE
Volume fraction for all DD zones: 0.066099
  Installing signal handler for SIGTERM
bHaveVdW[11]=TRUE
   bHaveVdW[12]=TRUE
 bHaveVdW[9]=TRUE
bHaveVdW[10]=TRUE
bHaveVdW[13]=TRUE
 DD rank 3 neighbor ranks in dir 0 are + 11 - 27
Volume fraction for all DD zones: 0.066099
Installing signal handler for SIGINT
       DD rank 5 neighbor ranks in dir 0 are + 13 - 29
  bHaveVdW[13]=TRUE
DD rank 3 neighbor ranks in dir 1 are + 5 - 1
Installing signal handler for SIGUSR1
 bHaveVdW[12]=TRUE
bHaveVdW[10]=TRUE
bHaveVdW[11]=TRUE
 Installing signal handler for SIGTERM
bHaveVdW[14]=TRUE
 DD rank 5 neighbor ranks in dir 1 are + 7 - 3
 DD rank 19 neighbor ranks in dir 0 are + 27 - 11
  DD rank 3 neighbor ranks in dir 2 are + 2 - 2
     Installing signal handler for SIGINT
 DD rank 5 neighbor ranks in dir 2 are + 4 - 4
 DD rank 19 neighbor ranks in dir 1 are + 21 - 17
  bHaveVdW[12]=TRUE
   Making load communicators
bHaveVdW[13]=TRUE
Installing signal handler for SIGUSR1
bHaveVdW[10]=TRUE
The total size of the atom to interaction index is 42398 integers
bHaveVdW[11]=TRUE
Making load communicators
bHaveVdW[14]=TRUE
 DD rank 19 neighbor ranks in dir 2 are + 18 - 18
      The total size of the atom to interaction index is 42398 integers
 bHaveVdW[14]=TRUE
The total size of the atom to interaction index is 42398 integers
 bHaveVdW[13]=TRUE
bHaveVdW[11]=TRUE
Installing signal handler for SIGTERM
Making load communicators
bHaveVdW[12]=TRUE
   Installing signal handler for SIGTERM
   Begin init_domdec_constraints
Installing signal handler for SIGINT
    Installing signal handler for SIGINT
bHaveVdW[13]=TRUE
  Installing signal handler for SIGUSR1
 bHaveVdW[14]=TRUE
bHaveVdW[11]=TRUE
bHaveVdW[12]=TRUE
Installing signal handler for SIGUSR1
The total size of the atom to interaction index is 42398 integers
Begin init_domdec_constraints
  PLINCS communication before each iteration: 1
 Begin init_domdec_constraints
 Hash table mod 2048 nalloc 2537
  Installing signal handler for SIGTERM
 bHaveVdW[14]=TRUE
bHaveVdW[12]=TRUE
bHaveVdW[13]=TRUE
LINCS: using 1 threads
  Installing signal handler for SIGINT
 Hash table mod 2048 nalloc 2537
The DD cut-off is 1.400000
 Begin init_domdec_constraints
Hash table mod 2048 nalloc 2537
  PLINCS communication before each iteration: 1
 Installing signal handler for SIGUSR1
bHaveVdW[14]=TRUE
  bHaveVdW[12]=TRUE
The DD cut-off is 1.400000
bHaveVdW[13]=TRUE
Volume fraction for all DD zones: 0.066099
   LINCS: using 1 threads
 bHaveVdW[13]=TRUE
bHaveVdW[14]=TRUE
 The DD cut-off is 1.400000
     bHaveVdW[13]=TRUE
bHaveVdW[14]=TRUE
  DD rank 4 neighbor ranks in dir 0 are + 12 - 28
bHaveVdW[14]=TRUE
 Volume fraction for all DD zones: 0.066099
DD rank 4 neighbor ranks in dir 1 are + 6 - 2
 Hash table mod 2048 nalloc 2537
DD rank 4 neighbor ranks in dir 2 are + 5 - 5
bHaveVdW[14]=TRUE
PLINCS communication before each iteration: 1
Volume fraction for all DD zones: 0.066099
DD rank 13 neighbor ranks in dir 0 are + 21 - 5
Making load communicators
DD rank 13 neighbor ranks in dir 1 are + 15 - 11
LINCS: using 1 threads
DD rank 13 neighbor ranks in dir 2 are + 12 - 12
Installing signal handler for SIGTERM
Installing signal handler for SIGINT
Installing signal handler for SIGUSR1
DD rank 27 neighbor ranks in dir 0 are + 3 - 19
The DD cut-off is 1.400000
DD rank 27 neighbor ranks in dir 1 are + 29 - 25
Making load communicators
DD rank 27 neighbor ranks in dir 2 are + 26 - 26
Making load communicators
Volume fraction for all DD zones: 0.066099
Installing signal handler for SIGTERM
Installing signal handler for SIGINT
Installing signal handler for SIGUSR1
DD rank 26 neighbor ranks in dir 0 are + 2 - 18
DD rank 26 neighbor ranks in dir 1 are + 28 - 24
DD rank 26 neighbor ranks in dir 2 are + 27 - 27
Making load communicators
Installing signal handler for SIGTERM
Installing signal handler for SIGINT
Installing signal handler for SIGUSR1
Installing signal handler for SIGTERM
Installing signal handler for SIGINT
Installing signal handler for SIGUSR1
Installing signal handler for SIGTERM
Installing signal handler for SIGINT
PLINCS communication before each iteration: 1
Installing signal handler for SIGUSR1
LINCS: using 1 threads
PLINCS communication before each iteration: 1
LINCS: using 1 threads
The total size of the atom to interaction index is 42398 integers
Installing signal handler for SIGTERM
Installing signal handler for SIGINT
Installing signal handler for SIGUSR1
Installing signal handler for SIGTERM
Begin init_domdec_constraints
Installing signal handler for SIGINT
Installing signal handler for SIGUSR1
The total size of the atom to interaction index is 42398 integers
Installing signal handler for SIGTERM
Installing signal handler for SIGINT
Installing signal handler for SIGUSR1
Installing signal handler for SIGTERM
Installing signal handler for SIGINT
Installing signal handler for SIGUSR1
PLINCS communication before each iteration: 1
LINCS: using 1 threads
The total size of the atom to interaction index is 42398 integers
Hash table mod 2048 nalloc 2537
Installing signal handler for SIGTERM
Installing signal handler for SIGINT
Installing signal handler for SIGUSR1
Begin init_domdec_constraints
The DD cut-off is 1.400000
Volume fraction for all DD zones: 0.066099
Begin init_domdec_constraints
PLINCS communication before each iteration: 1
Hash table mod 2048 nalloc 2537
LINCS: using 1 threads
DD rank 18 neighbor ranks in dir 0 are + 26 - 10
DD rank 18 neighbor ranks in dir 1 are + 20 - 16
DD rank 18 neighbor ranks in dir 2 are + 19 - 19
The DD cut-off is 1.400000
Making load communicators
PLINCS communication before each iteration: 1
Hash table mod 2048 nalloc 2537
LINCS: using 1 threads
Volume fraction for all DD zones: 0.066099
The total size of the atom to interaction index is 42398 integers
The DD cut-off is 1.400000
DD rank 20 neighbor ranks in dir 0 are + 28 - 12
DD rank 20 neighbor ranks in dir 1 are + 22 - 18
DD rank 20 neighbor ranks in dir 2 are + 21 - 21
PLINCS communication before each iteration: 1
Making load communicators
Volume fraction for all DD zones: 0.066099
LINCS: using 1 threads
PLINCS communication before each iteration: 1
PLINCS communication before each iteration: 1
The total size of the atom to interaction index is 42398 integers
LINCS: using 1 threads
Begin init_domdec_constraints
LINCS: using 1 threads
DD rank 11 neighbor ranks in dir 0 are + 19 - 3
DD rank 11 neighbor ranks in dir 1 are + 13 - 9
DD rank 11 neighbor ranks in dir 2 are + 10 - 10
Making load communicators
Hash table mod 2048 nalloc 2537
Begin init_domdec_constraints
The DD cut-off is 1.400000
PLINCS communication before each iteration: 1
LINCS: using 1 threads
Hash table mod 2048 nalloc 2537
Volume fraction for all DD zones: 0.066099
DD rank 10 neighbor ranks in dir 0 are + 18 - 2
DD rank 10 neighbor ranks in dir 1 are + 12 - 8
The total size of the atom to interaction index is 42398 integers
The DD cut-off is 1.400000
DD rank 10 neighbor ranks in dir 2 are + 11 - 11
PLINCS communication before each iteration: 1
PLINCS communication before each iteration: 1
Making load communicators
LINCS: using 1 threads
PLINCS communication before each iteration: 1
LINCS: using 1 threads
Volume fraction for all DD zones: 0.066099
LINCS: using 1 threads
DD rank 24 neighbor ranks in dir 0 are + 0 - 16
Begin init_domdec_constraints
DD rank 24 neighbor ranks in dir 1 are + 26 - 30
The total size of the atom to interaction index is 42398 integers
PLINCS communication before each iteration: 1
DD rank 24 neighbor ranks in dir 2 are + 25 - 25
LINCS: using 1 threads
Making load communicators
Hash table mod 2048 nalloc 2537
The total size of the atom to interaction index is 42398 integers
Begin init_domdec_constraints
The DD cut-off is 1.400000
Volume fraction for all DD zones: 0.066099
Begin init_domdec_constraints
The total size of the atom to interaction index is 42398 integers
Hash table mod 2048 nalloc 2537
The total size of the atom to interaction index is 42398 integers
The total size of the atom to interaction index is 42398 integers
DD rank 14 neighbor ranks in dir 0 are + 22 - 6
DD rank 14 neighbor ranks in dir 1 are + 8 - 12
DD rank 14 neighbor ranks in dir 2 are + 15 - 15
The DD cut-off is 1.400000
Making load communicators
Hash table mod 2048 nalloc 2537
Volume fraction for all DD zones: 0.066099
Begin init_domdec_constraints
Begin init_domdec_constraints
Begin init_domdec_constraints
The DD cut-off is 1.400000
DD rank 16 neighbor ranks in dir 0 are + 24 - 8
DD rank 16 neighbor ranks in dir 1 are + 18 - 22
DD rank 16 neighbor ranks in dir 2 are + 17 - 17
Making load communicators
Volume fraction for all DD zones: 0.066099
The total size of the atom to interaction index is 42398 integers
Hash table mod 2048 nalloc 2537
Hash table mod 2048 nalloc 2537
Hash table mod 2048 nalloc 2537
DD rank 8 neighbor ranks in dir 0 are + 16 - 0
DD rank 8 neighbor ranks in dir 1 are + 10 - 14
The DD cut-off is 1.400000
DD rank 8 neighbor ranks in dir 2 are + 9 - 9
The DD cut-off is 1.400000
The DD cut-off is 1.400000
The total size of the atom to interaction index is 42398 integers
Making load communicators
The total size of the atom to interaction index is 42398 integers
Begin init_domdec_constraints
Volume fraction for all DD zones: 0.066099
The total size of the atom to interaction index is 42398 integers
Volume fraction for all DD zones: 0.066099
Volume fraction for all DD zones: 0.066099
The total size of the atom to interaction index is 42398 integers
Hash table mod 2048 nalloc 2537
Begin init_domdec_constraints
Begin init_domdec_constraints
DD rank 12 neighbor ranks in dir 0 are + 20 - 4
DD rank 12 neighbor ranks in dir 1 are + 14 - 10
DD rank 12 neighbor ranks in dir 2 are + 13 - 13
DD rank 31 neighbor ranks in dir 0 are + 7 - 23
DD rank 31 neighbor ranks in dir 1 are + 25 - 29
DD rank 31 neighbor ranks in dir 2 are + 30 - 30
DD rank 9 neighbor ranks in dir 0 are + 17 - 1
Making load communicators
DD rank 9 neighbor ranks in dir 1 are + 11 - 15
Making load communicators
The DD cut-off is 1.400000
DD rank 9 neighbor ranks in dir 2 are + 8 - 8
Begin init_domdec_constraints
Hash table mod 2048 nalloc 2537
Hash table mod 2048 nalloc 2537
Making load communicators
Volume fraction for all DD zones: 0.066099
Hash table mod 2048 nalloc 2537
Begin init_domdec_constraints
The DD cut-off is 1.400000
The DD cut-off is 1.400000
DD rank 25 neighbor ranks in dir 0 are + 1 - 17
The DD cut-off is 1.400000
Volume fraction for all DD zones: 0.066099
Hash table mod 2048 nalloc 2537
DD rank 25 neighbor ranks in dir 1 are + 27 - 31
Volume fraction for all DD zones: 0.066099
Volume fraction for all DD zones: 0.066099
DD rank 25 neighbor ranks in dir 2 are + 24 - 24
DD rank 23 neighbor ranks in dir 0 are + 31 - 15
The DD cut-off is 1.400000
DD rank 30 neighbor ranks in dir 0 are + 6 - 22
Making load communicators
DD rank 23 neighbor ranks in dir 1 are + 17 - 21
DD rank 30 neighbor ranks in dir 1 are + 24 - 28
DD rank 1 neighbor ranks in dir 0 are + 9 - 25
DD rank 23 neighbor ranks in dir 2 are + 22 - 22
Volume fraction for all DD zones: 0.066099
DD rank 30 neighbor ranks in dir 2 are + 31 - 31
DD rank 1 neighbor ranks in dir 1 are + 3 - 7
Making load communicators
DD rank 1 neighbor ranks in dir 2 are + 0 - 0
Making load communicators
DD rank 28 neighbor ranks in dir 0 are + 4 - 20
Making load communicators
DD rank 28 neighbor ranks in dir 1 are + 30 - 26
DD rank 28 neighbor ranks in dir 2 are + 29 - 29
Making load communicators
Setting up tables
Opening library file /usr/local/gromacs/share/gromacs/top/bromacs.dat
Setting up tables
Opening library file /usr/local/gromacs/share/gromacs/top/bromacs.dat
Going to determine what solvent types we have.
Moltype 'NA+': there are 1 atoms in this charge group
Moltype 'W': there are 1 atoms in this charge group
The coordinates are bounded in 3 dimensions
Set ncg_ideal to 10
ns5_core: rs2 = 1.96, rm2 = 1.96, rl2 = 1.96 (nm^2)
bHaveVdW (15):
   bHaveVdW[0]=TRUE
   bHaveVdW[1]=TRUE
   bHaveVdW[2]=TRUE
   bHaveVdW[3]=TRUE
   bHaveVdW[4]=TRUE
   bHaveVdW[5]=TRUE
   bHaveVdW[6]=TRUE
   bHaveVdW[7]=TRUE
   bHaveVdW[8]=TRUE
   bHaveVdW[9]=TRUE
   bHaveVdW[10]=TRUE
   bHaveVdW[11]=TRUE
   bHaveVdW[12]=TRUE
   bHaveVdW[13]=TRUE
   bHaveVdW[14]=TRUE
graph part[] nchanged=748, bMultiPart=0
graph part[] nchanged=0, bMultiPart=0
graph part[] nchanged=748, bMultiPart=0
graph part[] nchanged=0, bMultiPart=0
graph part[] nchanged=748, bMultiPart=0
graph part[] nchanged=0, bMultiPart=0
graph part[] nchanged=748, bMultiPart=0
graph part[] nchanged=0, bMultiPart=0
graph part[] nchanged=748, bMultiPart=0
graph part[] nchanged=0, bMultiPart=0
graph part[] nchanged=748, bMultiPart=0
graph part[] nchanged=0, bMultiPart=0
Installing signal handler for SIGTERM
Installing signal handler for SIGINT
Installing signal handler for SIGUSR1
PLINCS communication before each iteration: 1
LINCS: using 1 threads
The total size of the atom to interaction index is 42398 integers
Begin init_domdec_constraints
Hash table mod 2048 nalloc 2537
The DD cut-off is 1.400000
Volume fraction for all DD zones: 0.066099
DD rank 0 neighbor ranks in dir 0 are + 8 - 24
DD rank 0 neighbor ranks in dir 1 are + 2 - 6
DD rank 0 neighbor ranks in dir 2 are + 1 - 1
Making load communicators
Finished making load communicators
Finished making load communicators
Finished making load communicators
Finished making load communicators
Finished making load communicators
Finished making load communicators
Finished making load communicators
Finished making load communicators
Finished making load communicators
Finished making load communicators
Finished making load communicators
Finished making load communicators
Finished making load communicators
Finished making load communicators
Finished making load communicators
Finished making load communicators
Finished making load communicators
Finished making load communicators
Finished making load communicators
Finished making load communicators
Finished making load communicators
Finished making load communicators
Finished making load communicators
Finished making load communicators
Finished making load communicators
Finished making load communicators
Finished making load communicators
Finished making load communicators
Finished making load communicators
Finished making load communicators
Finished making load communicators
Finished making load communicators
Creating 1 sized group matrix for energies
Creating 1 sized group matrix for energies
Creating 1 sized group matrix for energies
Creating 1 sized group matrix for energies
Creating 1 sized group matrix for energies
Creating 1 sized group matrix for energies
Creating 1 sized group matrix for energies
Creating 1 sized group matrix for energies
Creating 1 sized group matrix for energies
Creating 1 sized group matrix for energies
Creating 1 sized group matrix for energies
Creating 1 sized group matrix for energies
Creating 1 sized group matrix for energies
Creating 1 sized group matrix for energies
Creating 1 sized group matrix for energies
Creating 1 sized group matrix for energies
Creating 1 sized group matrix for energies
Creating 1 sized group matrix for energies
Creating 1 sized group matrix for energies
Creating 1 sized group matrix for energies
Creating 1 sized group matrix for energies
Creating 1 sized group matrix for energies
Creating 1 sized group matrix for energies
Creating 1 sized group matrix for energies
Creating 1 sized group matrix for energies
Creating 1 sized group matrix for energies
Creating 1 sized group matrix for energies
Creating 1 sized group matrix for energies
Creating 1 sized group matrix for energies
Creating 1 sized group matrix for energies
Creating 1 sized group matrix for energies
Creating 1 sized group matrix for energies
box[0]  19.700 0.000 0.000
  v[1]  0.000 1.000 0.000
  v[2]  0.707 0.000 1.000
skew_fac[0] = 0.816496
normal[0]  0.667 0.000 -0.471
box[1]  0.000 19.700 0.000
  v[2]  0.000 0.707 1.000
skew_fac[1] = 0.816496
normal[1]  0.000 0.667 -0.471
Home charge groups:
Home charge groups:
Home charge groups:
Home charge groups:
Home charge groups:
Home charge groups:
Home charge groups:
Home charge groups:
Home charge groups:
Home charge groups:
Home charge groups:
Home charge groups:
 3729Home charge groups:
Home charge groups:
Home charge groups:
Home charge groups:
Home charge groups:
Home charge groups:
 4573Home charge groups:
Home charge groups:
Home charge groups:
Home charge groups:
Home charge groups:
Home charge groups:
Home charge groups:
Home charge groups:
Home charge groups:
 282Home charge groups:
Home charge groups:
Home charge groups:
Home charge groups:
 2830Home charge groups:
 279 1330 6901 806 1458 171 1491 1 3742 5975 3734 579 711 7216 661 4574 71 2086 0 4523 2826 92 3673 4535 5673 283 4508 2680 2996 331 2831 584 289 1336 6931 866 1519 187 1495 2 4538 5986 3735 580 712 7260 662 4577 83 2158 8 4570 2827 98 3674 4566 5674 284 5130 2681 2997 335 2839 592 290 1337 6940 867 1526 188 1496 3 5127 5987 3736 581 4510 7270 667 4582 84 2160 13 4583 2828 99 3678 4567 5676 285 5132 2682 2998 339 2840 593 291 1338 6942 868 1528 189 1497 4 5142 5989 3737 583 8014 7372 668 4591 85 2165 14
 47161 47170 47176 47191
 47195 47205 47206 47222 47223 47233 47241 47243 47245 47250
 47268 47271 47275 47279 47285 47289 47294 47297 47301 47312
 47321 47327 47339 47341 47344 47350 47352 47840 47842 47852
 47882 47885 47913 47917 47929 47930 47934 47940 47944 47948
 47977
Reallocating state: currently 0, required 1502, allocating 1887
Reallocating state: currently 0, required 1465, allocating 1843
Reallocating state: currently 0, required 1489, allocating 1871
Reallocating state: currently 0, required 1469, allocating 1848
Reallocating state: currently 0, required 1604, allocating 2008
Reallocating state: currently 0, required 1479, allocating 1860
Reallocating state: currently 0, required 1455, allocating 1831
Reallocating state: currently 0, required 1451, allocating 1826
Reallocating state: currently 0, required 1741, allocating 2171
Reallocating state: currently 0, required 1479, allocating 1860
Reallocating state: currently 0, required 1445, allocating 1819
Reallocating state: currently 0, required 1580, allocating 1980
Reallocating state: currently 0, required 1493, allocating 1876
Reallocating state: currently 0, required 1523, allocating 1912
Reallocating state: currently 0, required 1462, allocating 1839
Reallocating state: currently 0, required 1455, allocating 1831
Reallocating state: currently 0, required 1447, allocating 1821
Reallocating state: currently 0, required 1561, allocating 1957
Reallocating state: currently 0, required 1551, allocating 1945
Reallocating state: currently 0, required 1442, allocating 1815
Reallocating state: currently 0, required 1591, allocating 1993
Reallocating state: currently 0, required 1463, allocating 1840
Reallocating state: currently 0, required 1695, allocating 2117
Reallocating state: currently 0, required 1428, allocating 1799
Reallocating state: currently 0, required 1455, allocating 1831
Reallocating state: currently 0, required 1471, allocating 1850
Reallocating state: currently 0, required 1475, allocating 1855
Reallocating state: currently 0, required 1463, allocating 1840
Reallocating state: currently 0, required 1466, allocating 1844
Reallocating state: currently 0, required 1474, allocating 1854
Reallocating state: currently 0, required 1461, allocating 1838
Reallocating state: currently 0, required 1461, allocating 1838
Reallocating forcerec: currently 0, required 1475, allocating 1855
Reallocating forcerec: currently 0, required 1447, allocating 1821
Reallocating forcerec: currently 0, required 1461, allocating 1838
Reallocating forcerec: currently 0, required 1428, allocating 1799
Reallocating forcerec: currently 0, required 1466, allocating 1844
Reallocating forcerec: currently 0, required 1502, allocating 1887
Reallocating forcerec: currently 0, required 1741, allocating 2171
Reallocating forcerec: currently 0, required 1695, allocating 2117
Reallocating forcerec: currently 0, required 1455, allocating 1831
Reallocating forcerec: currently 0, required 1561, allocating 1957
Reallocating forcerec: currently 0, required 1474, allocating 1854
Reallocating forcerec: currently 0, required 1445, allocating 1819
Reallocating forcerec: currently 0, required 1469, allocating 1848
Reallocating forcerec: currently 0, required 1523, allocating 1912
Reallocating forcerec: currently 0, required 1465, allocating 1843
Reallocating forcerec: currently 0, required 1451, allocating 1826
Reallocating forcerec: currently 0, required 1591, allocating 1993
Reallocating forcerec: currently 0, required 1479, allocating 1860
Reallocating forcerec: currently 0, required 1463, allocating 1840
Reallocating forcerec: currently 0, required 1442, allocating 1815
Reallocating forcerec: currently 0, required 1455, allocating 1831
Reallocating forcerec: currently 0, required 1462, allocating 1839
Reallocating forcerec: currently 0, required 1493, allocating 1876
Reallocating forcerec: currently 0, required 1604, allocating 2008
Reallocating forcerec: currently 0, required 1580, allocating 1980
Reallocating forcerec: currently 0, required 1551, allocating 1945
Reallocating forcerec: currently 0, required 1471, allocating 1850
Reallocating forcerec: currently 0, required 1455, allocating 1831
Reallocating forcerec: currently 0, required 1489, allocating 1871
cell_x[0] 9.850085 - 14.775127 skew_fac 0.816496
Reallocating forcerec: currently 0, required 1461, allocating 1838
cell_x[0] 14.775127 - 19.700171 skew_fac 0.816496
cell_x[0] 0.000000 - 4.925043 skew_fac 0.816496
Reallocating forcerec: currently 0, required 1479, allocating 1860
Reallocating forcerec: currently 0, required 1463, allocating 1840
cell_x[0] 4.925043 - 9.850085 skew_fac 0.816496
cell_x[0] 0.000000 - 4.925043 skew_fac 0.816496
cell_x[0] 4.925043 - 9.850085 skew_fac 0.816496
cell_x[0] 0.000000 - 4.925043 skew_fac 0.816496
cell_x[1] 9.850085 - 14.775127 skew_fac 0.816496
cell_x[1] 4.925043 - 9.850085 skew_fac 0.816496
cell_x[2] 0.000000 - 6.965060 skew_fac 1.000000
cell_x[2] 6.965060 - 13.930120 skew_fac 1.000000
cell_x[2] 6.965060 - 13.930120 skew_fac 1.000000
cell_x[2] 6.965060 - 13.930120 skew_fac 1.000000
cell_x[2] 6.965060 - 13.930120 skew_fac 1.000000
cell_x[2] 0.000000 - 6.965060 skew_fac 1.000000
cell_x[2] 0.000000 - 6.965060 skew_fac 1.000000
cell_x[2] 0.000000 - 6.965060 skew_fac 1.000000
cell_x[2] 0.000000 - 6.965060 skew_fac 1.000000
cell_x[2] 0.000000 - 6.965060 skew_fac 1.000000
cell_x[2] 6.965060 - 13.930120 skew_fac 1.000000
cell_x[2] 0.000000 - 6.965060 skew_fac 1.000000
cell_x[2] 6.965060 - 13.930120 skew_fac 1.000000
cell_x[2] 0.000000 - 6.965060 skew_fac 1.000000
cell_x[2] 6.965060 - 13.930120 skew_fac 1.000000
cell_x[2] 0.000000 - 6.965060 skew_fac 1.000000
cell_x[2] 0.000000 - 6.965060 skew_fac 1.000000
cell_x[2] 6.965060 - 13.930120 skew_fac 1.000000
cell_x[2] 6.965060 - 13.930120 skew_fac 1.000000
cell_x[2] 6.965060 - 13.930120 skew_fac 1.000000
cell_x[2] 6.965060 - 13.930120 skew_fac 1.000000
cell_x[2] 6.965060 - 13.930120 skew_fac 1.000000
Set grid boundaries dim 0: 9.850085 14.775127
cell_x[2] 6.965060 - 13.930120 skew_fac 1.000000
Set grid boundaries dim 0: 14.775127 19.700171
Set grid boundaries dim 0: 0.000000 4.925043
cell_x[2] 0.000000 - 6.965060 skew_fac 1.000000
cell_x[2] 0.000000 - 6.965060 skew_fac 1.000000
Set grid boundaries dim 0: 4.925043 9.850085
Set grid boundaries dim 0: 0.000000 4.925043
Set grid boundaries dim 0: 4.925043 9.850085
Set grid boundaries dim 0: 4.925043 9.850085
Set grid boundaries dim 0: 9.850085 14.775127
Set grid boundaries dim 0: 14.775127 19.700171
Set grid boundaries dim 0: 9.850085 14.775127
Set grid boundaries dim 0: 9.850085 14.775127
Set grid boundaries dim 1: 4.925043 9.850085
Set grid boundaries dim 1: 0.000000 4.925043
Set grid boundaries dim 2: 6.965060 13.930120
Set grid boundaries dim 2: 6.965060 13.930120
Set grid boundaries dim 2: 6.965060 13.930120
Set grid boundaries dim 2: 6.965060 13.930120
set_grid_sizes, i-zone bounds for dim 0:  9.850 14.775
Set grid boundaries dim 2: 6.965060 13.930120
set_grid_sizes, i-zone bounds for dim 0: 14.775 19.700
set_grid_sizes, i-zone bounds for dim 0:  0.000  4.925
Set grid boundaries dim 2: 0.000000 6.965060
Set grid boundaries dim 2: 0.000000 6.965060
set_grid_sizes, i-zone bounds for dim 0:  4.925  9.850
set_grid_sizes, i-zone bounds for dim 0:  0.000  4.925
set_grid_sizes, i-zone bounds for dim 0:  4.925  9.850
set_grid_sizes, i-zone bounds for dim 0:  4.925  9.850
set_grid_sizes, i-zone bounds for dim 0:  9.850 14.775
set_grid_sizes, i-zone bounds for dim 0: 14.775 19.700
set_grid_sizes, i-zone bounds for dim 0:  9.850 14.775
set_grid_sizes, i-zone bounds for dim 0:  9.850 14.775
set_grid_sizes, i-zone bounds for dim 0:  0.000  4.925
set_grid_sizes, i-zone bounds for dim 2:  6.965 13.930
set_grid_sizes, i-zone bounds for dim 2:  6.965 13.930
CG density 8.730662 ideal ns cell size 1.046287
set_grid_sizes, i-zone bounds for dim 2:  6.965 13.930
CG density 8.564926 ideal ns cell size 1.052993
CG density 8.647794 ideal ns cell size 1.049619
set_grid_sizes, i-zone bounds for dim 2:  0.000  6.965
set_grid_sizes, i-zone bounds for dim 2:  0.000  6.965
CG density 8.890478 ideal ns cell size 1.039980
CG density 8.677390 ideal ns cell size 1.048424
CG density 8.452464 ideal ns cell size 1.057643
CG density 10.305140 ideal ns cell size 0.990031
CG density 10.032864 ideal ns cell size 0.998907
CG density 8.612280 ideal ns cell size 1.051059
CG density 9.180513 ideal ns cell size 1.028911
CG density 8.706985 ideal ns cell size 1.047235
CG density 8.612279 ideal ns cell size 1.051060
CG density 8.813531 ideal ns cell size 1.042998
grid dim 0 size 11 x 1.051339: 9.850085 - 21.414816
CG density 8.647792 ideal ns cell size 1.049619
grid dim 0 size 11 x 1.051339: 14.775127 - 26.339859
grid dim 0 size 11 x 1.051339: 4.925045 - 16.489776
CG density 8.754337 ideal ns cell size 1.045343
CG density 8.659633 ideal ns cell size 1.049140
grid dim 0 size 11 x 1.051339: 4.925043 - 16.489774
grid dim 0 size 11 x 1.051339: 4.925045 - 16.489776
grid dim 0 size 11 x 1.051339: 4.925043 - 16.489774
grid dim 0 size 12 x 0.963728: 9.850088 - 21.414819
grid dim 0 size 12 x 0.963728: 9.850085 - 21.414816
grid dim 0 size 11 x 1.051339: 19.700172 - 31.264904
grid dim 0 size 11 x 1.051339: 14.775130 - 26.339861
grid dim 2 size 9 x 0.995009: 6.965060 - 15.920138
grid dim 2 size 9 x 0.995009: 6.965060 - 15.920138
grid dim 2 size 9 x 0.995009: 6.965060 - 15.920138
grid dim 2 size 9 x 0.995009: 6.965060 - 15.920138
CG ncg ideal 10, actual density 9.6
grid dim 2 size 9 x 0.995009: 6.965060 - 15.920138
CG ncg ideal 10, actual density 9.4
CG ncg ideal 10, actual density 9.5
grid dim 2 size 9 x 0.995009: 0.000000 - 8.955077
grid dim 2 size 9 x 0.995009: 0.000000 - 8.955077
CG ncg ideal 10, actual density 9.8
CG ncg ideal 10, actual density 10.3
CG ncg ideal 10, actual density 10.1
CG ncg ideal 10, actual density 9.6
CG ncg ideal 10, actual density 9.5
CG ncg ideal 10, actual density 9.7
Filling grid from 0 to 1475
CG ncg ideal 10, actual density 9.5
Filling grid from 0 to 1447
Filling grid from 0 to 1461
CG ncg ideal 10, actual density 9.6
CG ncg ideal 10, actual density 9.5
Filling grid from 0 to 1502
Filling grid from 0 to 1580
Filling grid from 0 to 1551
Filling grid from 0 to 1471
Filling grid from 0 to 1455
Filling grid from 0 to 1489
Step 0, sorting the 1475 home charge groups
Filling grid from 0 to 1461
Step 0, sorting the 1447 home charge groups
Step 0, sorting the 1461 home charge groups
Filling grid from 0 to 1479
Step 0, sorting the 1502 home charge groups
Filling grid from 0 to 1463
Step 0, sorting the 1580 home charge groups
Step 0, sorting the 1551 home charge groups
Step 0, sorting the 1471 home charge groups
Step 0, sorting the 1455 home charge groups
Step 0, sorting the 1489 home charge groups
qsort cgs: 1475 new home 1475
Step 0, sorting the 1461 home charge groups
qsort cgs: 1447 new home 1447
Step 0, sorting the 1479 home charge groups
qsort cgs: 1461 new home 1461
qsort cgs: 1502 new home 1502
Step 0, sorting the 1463 home charge groups
qsort cgs: 1466 new home 1466
qsort cgs: 1428 new home 1428
qsort cgs: 1741 new home 1741
qsort cgs: 1695 new home 1695
qsort cgs: 1455 new home 1455
qsort cgs: 1479 new home 1479
qsort cgs: 1463 new home 1463
Set the new home charge group count to 1475
Set the new home charge group count to 1447
Set the new home charge group count to 1461
Set the new home charge group count to 1462
Set the new home charge group count to 1493
Set the new home charge group count to 1604
Setting up DD communication
Set the new home charge group count to 1471
Set the new home charge group count to 1580
Set the new home charge group count to 1551
Setting up DD communication
Set the new home charge group count to 1455
Setting up DD communication
Setting up DD communication
Set the new home charge group count to 1489
Set the new home charge group count to 1461
Setting up DD communication
Setting up DD communication
Setting up DD communication
Set the new home charge group count to 1479
Setting up DD communication
Setting up DD communication
Set the new home charge group count to 1463
Setting up DD communication
Setting up DD communication
Setting up DD communication
Setting up DD communication
Setting up DD communication
Setting up DD communication
Setting up DD communication
Setting up DD communication
Setting up DD communication
Setting up DD communication
Setting up DD communication
Setting up DD communication
bBondComm 0, r_bc 1.400000
Setting up DD communication
Setting up DD communication
Setting up DD communication
bBondComm 0, r_bc 1.400000
Setting up DD communication
bBondComm 0, r_bc 1.400000
bBondComm 0, r_bc 1.400000
Setting up DD communication
Setting up DD communication
bBondComm 0, r_bc 1.400000
Setting up DD communication
bBondComm 0, r_bc 1.400000
bBondComm 0, r_bc 1.400000
Setting up DD communication
Setting up DD communication
bBondComm 0, r_bc 1.400000
bBondComm 0, r_bc 1.400000
bBondComm 0, r_bc 1.400000
bBondComm 0, r_bc 1.400000
Setting up DD communication
bBondComm 0, r_bc 1.400000
bBondComm 0, r_bc 1.400000
bBondComm 0, r_bc 1.400000
Setting up DD communication
bBondComm 0, r_bc 1.400000
bBondComm 0, r_bc 1.400000
bBondComm 0, r_bc 1.400000
bBondComm 0, r_bc 1.400000
bBondComm 0, r_bc 1.400000
bBondComm 0, r_bc 1.400000
bBondComm 0, r_bc 1.400000

skew_fac_01 0.500001
bBondComm 0, r_bc 1.400000
bBondComm 0, r_bc 1.400000
bBondComm 0, r_bc 1.400000

skew_fac_01 0.500001
bBondComm 0, r_bc 1.400000

skew_fac_01 0.500001

skew_fac_01 0.500001
bBondComm 0, r_bc 1.400000
bBondComm 0, r_bc 1.400000

skew_fac_01 0.500001
bBondComm 0, r_bc 1.400000

skew_fac_01 0.500001

skew_fac_01 0.500001
bBondComm 0, r_bc 1.400000
bBondComm 0, r_bc 1.400000

skew_fac_01 0.500001

skew_fac_01 0.500001

skew_fac_01 0.500001

skew_fac_01 0.500001
bBondComm 0, r_bc 1.400000

skew_fac_01 0.500001

skew_fac_01 0.500001

skew_fac_01 0.500001
bBondComm 0, r_bc 1.400000

skew_fac_01 0.500001

skew_fac_01 0.500001

skew_fac_01 0.500001

skew_fac_01 0.500001

skew_fac_01 0.500001

skew_fac_01 0.500001

skew_fac_01 0.500001

skew_fac_01 0.500001

skew_fac_01 0.500001

skew_fac_01 0.500001

skew_fac_01 0.500001

skew_fac_01 0.500001

skew_fac_01 0.500001

skew_fac_01 0.500001

skew_fac_01 0.500001

skew_fac_01 0.500001

skew_fac_01 0.500001

skew_fac_01 0.500001
Reallocating forcerec: currently 1912, required 2032, allocating 2518
Reallocating forcerec: currently 1840, required 1960, allocating 2432
Reallocating forcerec: currently 1887, required 2105, allocating 2604
Reallocating forcerec: currently 2117, required 2248, allocating 2775
Reallocating forcerec: currently 1821, required 1953, allocating 2424
Reallocating forcerec: currently 1993, required 2092, allocating 2589
Reallocating forcerec: currently 1799, required 1985, allocating 2462
Reallocating forcerec: currently 1826, required 1941, allocating 2409
Reallocating forcerec: currently 1815, required 1933, allocating 2400
Reallocating forcerec: currently 1839, required 2008, allocating 2489
Reallocating forcerec: currently 1945, required 2075, allocating 2569
Reallocating forcerec: currently 1854, required 1973, allocating 2447
Reallocating forcerec: currently 1850, required 1989, allocating 2466
Reallocating forcerec: currently 1838, required 1968, allocating 2441
Reallocating forcerec: currently 1838, required 1980, allocating 2456
Reallocating forcerec: currently 1860, required 1986, allocating 2463
Reallocating forcerec: currently 2171, required 2316, allocating 2856
Reallocating forcerec: currently 1831, required 1950, allocating 2420
Reallocating forcerec: currently 1844, required 2073, allocating 2566
Reallocating forcerec: currently 1957, required 2069, allocating 2562
Reallocating forcerec: currently 1980, required 2112, allocating 2613
Reallocating forcerec: currently 1831, required 1959, allocating 2431
Reallocating forcerec: currently 1871, required 1999, allocating 2478
Reallocating forcerec: currently 1819, required 1976, allocating 2451
Reallocating forcerec: currently 2008, required 2147, allocating 2654
Reallocating forcerec: currently 1860, required 2042, allocating 2529
Reallocating forcerec: currently 1843, required 1958, allocating 2430
Reallocating forcerec: currently 1876, required 2011, allocating 2493
Reallocating forcerec: currently 1831, required 1966, allocating 2439
Reallocating forcerec: currently 1840, required 1964, allocating 2437
Reallocating forcerec: currently 1855, required 1983, allocating 2459
Reallocating forcerec: currently 1848, required 1986, allocating 2463
Reallocating forcerec: currently 2420, required 2630, allocating 3229
Reallocating forcerec: currently 2431, required 2663, allocating 3268
Reallocating forcerec: currently 2441, required 2644, allocating 3246
Reallocating forcerec: currently 2400, required 2630, allocating 3229
Reallocating forcerec: currently 2856, required 3092, allocating 3779
Reallocating forcerec: currently 2569, required 2900, allocating 3551
Reallocating forcerec: currently 2613, required 2825, allocating 3461
Reallocating forcerec: currently 2463, required 2637, allocating 3238
Reallocating forcerec: currently 2478, required 2702, allocating 3315
Reallocating forcerec: currently 2447, required 2706, allocating 3320
Reallocating forcerec: currently 2562, required 2772, allocating 3398
Reallocating forcerec: currently 2466, required 2648, allocating 3251
Reallocating forcerec: currently 2566, required 2772, allocating 3398
Reallocating forcerec: currently 2489, required 2751, allocating 3373
Reallocating forcerec: currently 2451, required 2672, allocating 3279
Reallocating forcerec: currently 2456, required 2652, allocating 3255
Reallocating forcerec: currently 2493, required 2690, allocating 3301
Reallocating forcerec: currently 2424, required 2681, allocating 3290
Reallocating forcerec: currently 2463, required 2665, allocating 3271
Reallocating forcerec: currently 2518, required 2748, allocating 3370
Reallocating forcerec: currently 2529, required 2733, allocating 3352
Reallocating forcerec: currently 2439, required 2655, allocating 3259
Reallocating forcerec: currently 2462, required 2670, allocating 3277
Reallocating forcerec: currently 2604, required 2868, allocating 3512
Reallocating forcerec: currently 2589, required 2879, allocating 3526
Reallocating forcerec: currently 2459, required 2700, allocating 3313
Reallocating forcerec: currently 2775, required 3075, allocating 3759
Reallocating forcerec: currently 2654, required 2838, allocating 3477
Reallocating forcerec: currently 2432, required 2646, allocating 3248
Reallocating forcerec: currently 2430, required 2643, allocating 3245
Reallocating forcerec: currently 2409, required 2611, allocating 3207
Reallocating forcerec: currently 2437, required 2651, allocating 3254
Finished setting up DD communication, zones:Finished setting up DD communication, zones: 1442 1469 491 517 185 177 512 502 61 61 285 296 67 60 18 13Finished setting up DD communication, zones:Finished setting up DD communication, zones:

 1455 1447Finished setting up DD communication, zones: 495Finished setting up DD communication, zones: 506 1493Finished setting up DD communication, zones:Finished setting up DD communication, zones: 172 1461 178 518 1523Finished setting up DD communication, zones:Finished setting up DD communication, zones: 1455Making local topology
 508 507 550 177Finished setting up DD communication, zones:Finished setting up DD communication, zones:Making local topology
 509 1479 1479 504Two-body bonded cut-off distance is 1.4
Finished setting up DD communication, zones:Finished setting up DD communication, zones: 65 174 65 502 1551 1455Two-body bonded cut-off distance is 1.4
Finished setting up DD communication, zones:Finished setting up DD communication, zones: 185 507 563Finished setting up DD communication, zones:Finished setting up DD communication, zones: 182dim 0 cellmin 4.021279 bonded rcheck[0] = 0, bRCheck2B = 0
 1580 1502 277 502 295Finished setting up DD communication, zones: 69Finished setting up DD communication, zones: 524Finished setting up DD communication, zones:Finished setting up DD communication, zones: 511Finished setting up DD communication, zones:Finished setting up DD communication, zones:dim 0 cellmin 4.021279 bonded rcheck[0] = 0, bRCheck2B = 0
 1591Finished setting up DD communication, zones: 1561Finished setting up DD communication, zones: 531Finished setting up DD communication, zones:Finished setting up DD communication, zones:Finished setting up DD communication, zones:Finished setting up DD communication, zones: 168Finished setting up DD communication, zones:Finished setting up DD communication, zones: 183 1741 1428 522dim 1 cellmin 4.021279 bonded rcheck[1] = 0, bRCheck2B = 0
 532 603 70 65 61 1604 295 1471 211 1474 1475 194 1489 1695dim 1 cellmin 4.021279 bonded rcheck[1] = 0, bRCheck2B = 0
 501 1463 508 1445 65 1451 1463 1462 1465 483 1466 1461 508 575 557 68dim 2 cellmin 6.965060 bonded rcheck[2] = 0, bRCheck2B = 0
 178 226 13 292 13 543 60 518 614 499 508 495 510 553dim 2 cellmin 6.965060 bonded rcheck[2] = 0, bRCheck2B = 0
 216 497 180 531 303 490 501 546 493 71 607 519 58 198 192 285 535 537
 63
 176 14 173 62 184 180 74 181 204 571 172 523 185 59 168 176 219 180 274 197 170 303 578 493 60 63 71 14 515
We have 1442 exclusions, check count 0
 486 282 549 537Making local topology
 295 522 623Making local topology
 70 514 64 511 13 502 511 524 505 68We have 1469 exclusions, check count 0
 502 502 66 58 77 15 279 352
 65Constraints: home   0 border   0 atoms:   0
 71 70 60 79Two-body bonded cut-off distance is 1.4
 77 70Making local topology
 67Two-body bonded cut-off distance is 1.4
 358 63 282 65
 63 64 68 59 19Constraints: home   0 border   0 atoms:   0
 67 67 16 268 332
 66 77 297Begin setup_specat_communication for constraint
 301 14 293 309Making local topology
dim 0 cellmin 4.021279 bonded rcheck[0] = 0, bRCheck2B = 0
 22 282Two-body bonded cut-off distance is 1.4
 310dim 0 cellmin 4.021279 bonded rcheck[0] = 0, bRCheck2B = 0
 65 284 57 300 276 272 291 284
Begin setup_specat_communication for constraint
 293Making local topology
 287
 66 99 15 14 69 70
 65Making local topology
 65Two-body bonded cut-off distance is 1.4
dim 1 cellmin 4.021279 bonded rcheck[1] = 0, bRCheck2B = 0

 62dim 0 cellmin 4.021279 bonded rcheck[0] = 0, bRCheck2B = 0
 66dim 1 cellmin 4.021279 bonded rcheck[1] = 0, bRCheck2B = 0
 15 62 15 57 65 58 65 72 56Two-body bonded cut-off distance is 1.4
 50 14 16
Making local topology

 16 16 14Two-body bonded cut-off distance is 1.4
Making local topology
 17dim 0 cellmin 4.021279 bonded rcheck[0] = 0, bRCheck2B = 0
Making local topology
dim 2 cellmin 6.965060 bonded rcheck[2] = 0, bRCheck2B = 0
 18dim 1 cellmin 4.021279 bonded rcheck[1] = 0, bRCheck2B = 0
 16Making local topology
dim 2 cellmin 6.965060 bonded rcheck[2] = 0, bRCheck2B = 0

 15
 14 13 15 15 11 10dim 0 cellmin 4.021279 bonded rcheck[0] = 0, bRCheck2B = 0
 16

Two-body bonded cut-off distance is 1.4



dim 0 cellmin 4.021279 bonded rcheck[0] = 0, bRCheck2B = 0
Two-body bonded cut-off distance is 1.4

Making local topology
Making local topology
dim 1 cellmin 4.021279 bonded rcheck[1] = 0, bRCheck2B = 0
Two-body bonded cut-off distance is 1.4

dim 2 cellmin 6.965060 bonded rcheck[2] = 0, bRCheck2B = 0

Two-body bonded cut-off distance is 1.4







Making local topology
Making local topology
dim 1 cellmin 4.021279 bonded rcheck[1] = 0, bRCheck2B = 0

dim 0 cellmin 4.021279 bonded rcheck[0] = 0, bRCheck2B = 0
Making local topology
Making local topology
dim 1 cellmin 4.021279 bonded rcheck[1] = 0, bRCheck2B = 0
dim 0 cellmin 4.021279 bonded rcheck[0] = 0, bRCheck2B = 0
Making local topology
Two-body bonded cut-off distance is 1.4
Making local topology
Two-body bonded cut-off distance is 1.4
dim 2 cellmin 6.965060 bonded rcheck[2] = 0, bRCheck2B = 0
Making local topology
dim 0 cellmin 4.021279 bonded rcheck[0] = 0, bRCheck2B = 0
Making local topology
We have 1455 exclusions, check count 0
Making local topology
dim 0 cellmin 4.021279 bonded rcheck[0] = 0, bRCheck2B = 0
Two-body bonded cut-off distance is 1.4
Two-body bonded cut-off distance is 1.4
Making local topology
Making local topology
Making local topology
dim 2 cellmin 6.965060 bonded rcheck[2] = 0, bRCheck2B = 0
Making local topology
Making local topology
We have 1479 exclusions, check count 18
Making local topology
Making local topology
dim 1 cellmin 4.021279 bonded rcheck[1] = 0, bRCheck2B = 0
Two-body bonded cut-off distance is 1.4
Two-body bonded cut-off distance is 1.4
Making local topology
dim 2 cellmin 6.965060 bonded rcheck[2] = 0, bRCheck2B = 0
Making local topology
dim 1 cellmin 4.021279 bonded rcheck[1] = 0, bRCheck2B = 0
Two-body bonded cut-off distance is 1.4
dim 0 cellmin 4.021279 bonded rcheck[0] = 0, bRCheck2B = 0
Two-body bonded cut-off distance is 1.4
dim 0 cellmin 4.021279 bonded rcheck[0] = 0, bRCheck2B = 0
We have 1611 exclusions, check count 59
Two-body bonded cut-off distance is 1.4
dim 1 cellmin 4.021279 bonded rcheck[1] = 0, bRCheck2B = 0
Two-body bonded cut-off distance is 1.4
Constraints: home   0 border   0 atoms:   0
Two-body bonded cut-off distance is 1.4
dim 1 cellmin 4.021279 bonded rcheck[1] = 0, bRCheck2B = 0
dim 0 cellmin 4.021279 bonded rcheck[0] = 0, bRCheck2B = 0
dim 0 cellmin 4.021279 bonded rcheck[0] = 0, bRCheck2B = 0
Two-body bonded cut-off distance is 1.4
Two-body bonded cut-off distance is 1.4
Two-body bonded cut-off distance is 1.4
Two-body bonded cut-off distance is 1.4
Two-body bonded cut-off distance is 1.4
We have 1476 exclusions, check count 8
Two-body bonded cut-off distance is 1.4
Two-body bonded cut-off distance is 1.4
Constraints: home   1 border   9 atoms:   6
dim 2 cellmin 6.965060 bonded rcheck[2] = 0, bRCheck2B = 0
dim 0 cellmin 4.021279 bonded rcheck[0] = 0, bRCheck2B = 0
dim 0 cellmin 4.021279 bonded rcheck[0] = 0, bRCheck2B = 0
Two-body bonded cut-off distance is 1.4
Two-body bonded cut-off distance is 1.4
dim 2 cellmin 6.965060 bonded rcheck[2] = 0, bRCheck2B = 0
dim 0 cellmin 4.021279 bonded rcheck[0] = 0, bRCheck2B = 0
dim 1 cellmin 4.021279 bonded rcheck[1] = 0, bRCheck2B = 0
dim 0 cellmin 4.021279 bonded rcheck[0] = 0, bRCheck2B = 0
dim 1 cellmin 4.021279 bonded rcheck[1] = 0, bRCheck2B = 0
dim 0 cellmin 4.021279 bonded rcheck[0] = 0, bRCheck2B = 0
dim 2 cellmin 6.965060 bonded rcheck[2] = 0, bRCheck2B = 0
dim 0 cellmin 4.021279 bonded rcheck[0] = 0, bRCheck2B = 0
Constraints: home  10 border   6 atoms:   5
Begin setup_specat_communication for constraint
dim 0 cellmin 4.021279 bonded rcheck[0] = 0, bRCheck2B = 0
dim 2 cellmin 6.965060 bonded rcheck[2] = 0, bRCheck2B = 0
dim 1 cellmin 4.021279 bonded rcheck[1] = 0, bRCheck2B = 0
dim 1 cellmin 4.021279 bonded rcheck[1] = 0, bRCheck2B = 0
dim 0 cellmin 4.021279 bonded rcheck[0] = 0, bRCheck2B = 0
dim 0 cellmin 4.021279 bonded rcheck[0] = 0, bRCheck2B = 0
dim 0 cellmin 4.021279 bonded rcheck[0] = 0, bRCheck2B = 0
We have 1822 exclusions, check count 152
dim 0 cellmin 4.021279 bonded rcheck[0] = 0, bRCheck2B = 0
dim 0 cellmin 4.021279 bonded rcheck[0] = 0, bRCheck2B = 0
We have 1455 exclusions, check count 0
Constraints: home   0 border   0 atoms:   0
dim 0 cellmin 4.021279 bonded rcheck[0] = 0, bRCheck2B = 0
dim 0 cellmin 4.021279 bonded rcheck[0] = 0, bRCheck2B = 0
Begin setup_specat_communication for constraint
dim 1 cellmin 4.021279 bonded rcheck[1] = 0, bRCheck2B = 0
dim 1 cellmin 4.021279 bonded rcheck[1] = 0, bRCheck2B = 0
dim 0 cellmin 4.021279 bonded rcheck[0] = 0, bRCheck2B = 0
dim 0 cellmin 4.021279 bonded rcheck[0] = 0, bRCheck2B = 0
dim 1 cellmin 4.021279 bonded rcheck[1] = 0, bRCheck2B = 0
dim 2 cellmin 6.965060 bonded rcheck[2] = 0, bRCheck2B = 0
dim 1 cellmin 4.021279 bonded rcheck[1] = 0, bRCheck2B = 0
We have 1515 exclusions, check count 18
dim 2 cellmin 6.965060 bonded rcheck[2] = 0, bRCheck2B = 0
dim 1 cellmin 4.021279 bonded rcheck[1] = 0, bRCheck2B = 0
dim 1 cellmin 4.021279 bonded rcheck[1] = 0, bRCheck2B = 0
Begin setup_specat_communication for constraint
We have 1687 exclusions, check count 113
dim 1 cellmin 4.021279 bonded rcheck[1] = 0, bRCheck2B = 0
dim 2 cellmin 6.965060 bonded rcheck[2] = 0, bRCheck2B = 0
dim 2 cellmin 6.965060 bonded rcheck[2] = 0, bRCheck2B = 0
dim 1 cellmin 4.021279 bonded rcheck[1] = 0, bRCheck2B = 0
dim 1 cellmin 4.021279 bonded rcheck[1] = 0, bRCheck2B = 0
dim 1 cellmin 4.021279 bonded rcheck[1] = 0, bRCheck2B = 0
dim 1 cellmin 4.021279 bonded rcheck[1] = 0, bRCheck2B = 0
dim 1 cellmin 4.021279 bonded rcheck[1] = 0, bRCheck2B = 0
Begin setup_specat_communication for constraint
Constraints: home  20 border   4 atoms:   3
dim 1 cellmin 4.021279 bonded rcheck[1] = 0, bRCheck2B = 0
Constraints: home   0 border   0 atoms:   0
dim 1 cellmin 4.021279 bonded rcheck[1] = 0, bRCheck2B = 0
dim 2 cellmin 6.965060 bonded rcheck[2] = 0, bRCheck2B = 0
dim 2 cellmin 6.965060 bonded rcheck[2] = 0, bRCheck2B = 0
dim 1 cellmin 4.021279 bonded rcheck[1] = 0, bRCheck2B = 0
We have 2250 exclusions, check count 374
We have 1460 exclusions, check count 4
dim 1 cellmin 4.021279 bonded rcheck[1] = 0, bRCheck2B = 0
dim 2 cellmin 6.965060 bonded rcheck[2] = 0, bRCheck2B = 0
dim 2 cellmin 6.965060 bonded rcheck[2] = 0, bRCheck2B = 0
Constraints: home   0 border   1 atoms:   1
dim 2 cellmin 6.965060 bonded rcheck[2] = 0, bRCheck2B = 0
dim 2 cellmin 6.965060 bonded rcheck[2] = 0, bRCheck2B = 0
Constraints: home  21 border   3 atoms:   3
dim 2 cellmin 6.965060 bonded rcheck[2] = 0, bRCheck2B = 0
dim 2 cellmin 6.965060 bonded rcheck[2] = 0, bRCheck2B = 0
dim 2 cellmin 6.965060 bonded rcheck[2] = 0, bRCheck2B = 0
dim 2 cellmin 6.965060 bonded rcheck[2] = 0, bRCheck2B = 0
dim 2 cellmin 6.965060 bonded rcheck[2] = 0, bRCheck2B = 0
dim 2 cellmin 6.965060 bonded rcheck[2] = 0, bRCheck2B = 0
Begin setup_specat_communication for constraint
dim 2 cellmin 6.965060 bonded rcheck[2] = 0, bRCheck2B = 0
Begin setup_specat_communication for constraint
dim 2 cellmin 6.965060 bonded rcheck[2] = 0, bRCheck2B = 0
dim 2 cellmin 6.965060 bonded rcheck[2] = 0, bRCheck2B = 0
We have 2370 exclusions, check count 403
dim 2 cellmin 6.965060 bonded rcheck[2] = 0, bRCheck2B = 0
Constraints: home   0 border   0 atoms:   0
Constraints: home  50 border  17 atoms:  13
Begin setup_specat_communication for constraint
Begin setup_specat_communication for constraint
Begin setup_specat_communication for constraint
Begin setup_specat_communication for constraint
Constraints: home  73 border  11 atoms:   9
Begin setup_specat_communication for constraint
We have 1974 exclusions, check count 269
Constraints: home  34 border  14 atoms:  12
Begin setup_specat_communication for constraint
We have 2511 exclusions, check count 492
We have 2050 exclusions, check count 246
Constraints: home  79 border  17 atoms:  14
Begin setup_specat_communication for constraint
Constraints: home  48 border  15 atoms:  11
Begin setup_specat_communication for constraint
We have 1589 exclusions, check count 92
We have 3450 exclusions, check count 890
Constraints: home  13 border   2 atoms:   2
Begin setup_specat_communication for constraint
We have 1474 exclusions, check count 3
Constraints: home 142 border  27 atoms:  22
Begin setup_specat_communication for constraint
Constraints: home   0 border   0 atoms:   0
Begin setup_specat_communication for constraint
We have 2360 exclusions, check count 389
We have 1643 exclusions, check count 92
We have 1573 exclusions, check count 42
We have 1549 exclusions, check count 48
Constraints: home  67 border  10 atoms:   9
Begin setup_specat_communication for constraint
We have 1463 exclusions, check count 0
Constraints: home  14 border   7 atoms:   5
Constraints: home   7 border   0 atoms:   0
We have 1479 exclusions, check count 18
Begin setup_specat_communication for constraint
Constraints: home   3 border   2 atoms:   2
Begin setup_specat_communication for constraint
Constraints: home   0 border   0 atoms:   0
We have 3298 exclusions, check count 836
Begin setup_specat_communication for constraint
We have 1451 exclusions, check count 0
We have 1463 exclusions, check count 0
Begin setup_specat_communication for constraint
Constraints: home   5 border   0 atoms:   0
We have 1465 exclusions, check count 0
We have 1628 exclusions, check count 99
Constraints: home   0 border   0 atoms:   0
We have 1726 exclusions, check count 143
Constraints: home   0 border   0 atoms:   0
We have 1470 exclusions, check count 6
Begin setup_specat_communication for constraint
Constraints: home   0 border   0 atoms:   0
Constraints: home 143 border  19 atoms:  17
Constraints: home   5 border   3 atoms:   3
Begin setup_specat_communication for constraint
Constraints: home  25 border   9 atoms:   7
Begin setup_specat_communication for constraint
Constraints: home   0 border   0 atoms:   0
Begin setup_specat_communication for constraint
Begin setup_specat_communication for constraint
Begin setup_specat_communication for constraint
Begin setup_specat_communication for constraint
Begin setup_specat_communication for constraint
Communicated the counts
Communicated the counts
Communicated the counts
Communicated the counts
Communicated the counts
Communicated the counts
Communicated the counts
Communicated the counts
Communicated the counts
Communicated the counts
Communicated the counts
Communicated the counts
Communicated the counts
Communicated the counts
Communicated the counts
Communicated the counts
Communicated the counts
Communicated the counts
Communicated the counts
Communicated the counts
Communicated the counts
Communicated the counts
dim=0, dir=1, searching for 49 atoms
Communicated the counts
Communicated the counts
dim=0, dir=1, searching for 9 atoms
Communicated the counts
Communicated the counts
Communicated the counts
Communicated the counts
Communicated the counts
Communicated the counts
Communicated the counts
Communicated the counts
dim=0, dir=1, searching for 58 atoms
dim=0, dir=1, searching for 10 atoms
dim=0, dir=1, searching for 3 atoms
dim=0, dir=1, searching for 49 atoms
dim=0, dir=1, searching for 8 atoms
dim=0, dir=1, searching for 38 atoms
dim=0, dir=1, searching for 14 atoms
dim=0, dir=1, searching for 41 atoms
dim=0, dir=1, searching for 41 atoms
dim=0, dir=1, searching for 7 atoms
dim=0, dir=1, searching for 10 atoms
dim=0, dir=1, searching for 51 atoms
dim=0, dir=1, searching for 11 atoms
dim=0, dir=1, searching for 33 atoms
dim=0, dir=1, searching for 49 atoms
dim=0, dir=1, searching for 14 atoms
dim=0, dir=1, searching for 9 atoms
dim=0, dir=1, searching for 58 atoms
dim=0, dir=1, searching for 49 atoms
dim=0, dir=1, searching for 51 atoms
dim=0, dir=1, searching for 3 atoms
dim=0, dir=1, searching for 10 atoms
dim=0, dir=1, searching for 33 atoms
dim=0, dir=1, searching for 11 atoms
dim=0, dir=1, searching for 41 atoms
dim=0, dir=1, searching for 38 atoms
dim=0, dir=1, searching for 10 atoms
dim=0, dir=1, searching for 41 atoms
dim=0, dir=1, searching for 8 atoms
dim=0, dir=1, searching for 7 atoms
Send to node 19, 5 (4) indices, receive from node 3, 2 (2) indices
Send to node 27, 0 (0) indices, receive from node 11, 5 (4) indices
Send to node 3, 0 (0) indices, receive from node 19, 0 (0) indices
Send to node 11, 2 (2) indices, receive from node 27, 0 (0) indices
Send to node 5, 0 (0) indices, receive from node 21, 0 (0) indices
Send to node 7, 0 (0) indices, receive from node 23, 0 (0) indices
Send to node 9, 4 (4) indices, receive from node 25, 0 (0) indices
Send to node 29, 0 (0) indices, receive from node 13, 0 (0) indices
Send to node 13, 0 (0) indices, receive from node 29, 0 (0) indices
Send to node 21, 0 (0) indices, receive from node 5, 0 (0) indices
Send to node 17, 0 (0) indices, receive from node 1, 4 (4) indices
Send to node 25, 0 (0) indices, receive from node 9, 0 (0) indices
Send to node 1, 0 (0) indices, receive from node 17, 0 (0) indices
Send to node 31, 0 (0) indices, receive from node 15, 0 (0) indices
Send to node 15, 0 (0) indices, receive from node 31, 0 (0) indices
Send to node 23, 0 (0) indices, receive from node 7, 0 (0) indices
Send to node 18, 0 (0) indices, receive from node 2, 0 (0) indices
Send to node 20, 4 (4) indices, receive from node 4, 0 (0) indices
Send to node 28, 2 (2) indices, receive from node 12, 4 (4) indices
Send to node 4, 0 (0) indices, receive from node 20, 2 (2) indices
Send to node 12, 0 (0) indices, receive from node 28, 0 (0) indices
Send to node 10, 0 (0) indices, receive from node 26, 0 (0) indices
Send to node 2, 0 (0) indices, receive from node 18, 4 (4) indices
Send to node 26, 4 (4) indices, receive from node 10, 0 (0) indices
Send to node 0, 0 (0) indices, receive from node 16, 0 (0) indices
Send to node 24, 0 (0) indices, receive from node 8, 0 (0) indices
Send to node 8, 0 (0) indices, receive from node 24, 0 (0) indices
Send to node 16, 0 (0) indices, receive from node 0, 0 (0) indices
Send to node 22, 0 (0) indices, receive from node 6, 0 (0) indices
Send to node 14, 0 (0) indices, receive from node 30, 0 (0) indices
Send to node 6, 0 (0) indices, receive from node 22, 5 (5) indices
Send to node 30, 5 (5) indices, receive from node 14, 0 (0) indices
dim=0, dir=0, searching for 58 atoms
dim=0, dir=0, searching for 49 atoms
dim=0, dir=0, searching for 9 atoms
dim=0, dir=0, searching for 10 atoms
dim=0, dir=0, searching for 51 atoms
dim=0, dir=0, searching for 33 atoms
dim=0, dir=0, searching for 49 atoms
dim=0, dir=0, searching for 14 atoms
dim=0, dir=0, searching for 3 atoms
dim=0, dir=0, searching for 11 atoms
dim=0, dir=0, searching for 10 atoms
dim=0, dir=0, searching for 41 atoms
dim=0, dir=0, searching for 41 atoms
dim=0, dir=0, searching for 38 atoms
dim=0, dir=0, searching for 8 atoms
dim=0, dir=0, searching for 7 atoms
dim=0, dir=0, searching for 10 atoms
dim=0, dir=0, searching for 3 atoms
dim=0, dir=0, searching for 51 atoms
dim=0, dir=0, searching for 49 atoms
dim=0, dir=0, searching for 14 atoms
dim=0, dir=0, searching for 9 atoms
dim=0, dir=0, searching for 58 atoms
dim=0, dir=0, searching for 49 atoms
dim=0, dir=0, searching for 41 atoms
dim=0, dir=0, searching for 41 atoms
dim=0, dir=0, searching for 11 atoms
dim=0, dir=0, searching for 10 atoms
dim=0, dir=0, searching for 7 atoms
dim=0, dir=0, searching for 8 atoms
dim=0, dir=0, searching for 38 atoms
dim=0, dir=0, searching for 33 atoms
Send to node 19, 0 (0) indices, receive from node 3, 0 (0) indices
Send to node 27, 0 (0) indices, receive from node 11, 2 (2) indices
Send to node 11, 6 (6) indices, receive from node 27, 0 (0) indices
Send to node 3, 2 (2) indices, receive from node 19, 6 (6) indices
Send to node 21, 0 (0) indices, receive from node 5, 0 (0) indices
Send to node 29, 0 (0) indices, receive from node 13, 0 (0) indices
Send to node 5, 0 (0) indices, receive from node 21, 0 (0) indices
Send to node 13, 0 (0) indices, receive from node 29, 0 (0) indices
Send to node 1, 6 (6) indices, receive from node 17, 0 (0) indices
Send to node 25, 0 (0) indices, receive from node 9, 6 (6) indices
Send to node 17, 0 (0) indices, receive from node 1, 0 (0) indices
Send to node 9, 0 (0) indices, receive from node 25, 0 (0) indices
Send to node 23, 0 (0) indices, receive from node 7, 0 (0) indices
Send to node 31, 0 (0) indices, receive from node 15, 0 (0) indices
Send to node 7, 0 (0) indices, receive from node 23, 0 (0) indices
Send to node 15, 0 (0) indices, receive from node 31, 0 (0) indices
Send to node 12, 3 (3) indices, receive from node 28, 2 (2) indices
Send to node 20, 2 (2) indices, receive from node 4, 0 (0) indices
Send to node 28, 0 (0) indices, receive from node 12, 0 (0) indices
Send to node 4, 0 (0) indices, receive from node 20, 3 (3) indices
Send to node 2, 0 (0) indices, receive from node 18, 1 (0) indices
Send to node 18, 4 (4) indices, receive from node 2, 0 (0) indices
Send to node 10, 1 (0) indices, receive from node 26, 4 (4) indices
Send to node 26, 0 (0) indices, receive from node 10, 0 (0) indices
Send to node 16, 0 (0) indices, receive from node 0, 0 (0) indices
Send to node 24, 0 (0) indices, receive from node 8, 0 (0) indices
Send to node 0, 0 (0) indices, receive from node 16, 0 (0) indices
Send to node 8, 0 (0) indices, receive from node 24, 0 (0) indices
Send to node 6, 0 (0) indices, receive from node 22, 0 (0) indices
Send to node 14, 0 (0) indices, receive from node 30, 4 (4) indices
Send to node 30, 0 (0) indices, receive from node 14, 0 (0) indices
Send to node 22, 4 (4) indices, receive from node 6, 0 (0) indices
dim=1, dir=1, searching for 3 atoms
dim=1, dir=1, searching for 17 atoms
dim=1, dir=1, searching for 21 atoms
dim=1, dir=1, searching for 0 atoms
dim=1, dir=1, searching for 5 atoms
dim=1, dir=1, searching for 0 atoms
dim=1, dir=1, searching for 4 atoms
dim=1, dir=1, searching for 9 atoms
dim=1, dir=1, searching for 24 atoms
dim=1, dir=1, searching for 3 atoms
dim=1, dir=1, searching for 6 atoms
dim=1, dir=1, searching for 25 atoms
dim=1, dir=1, searching for 0 atoms
dim=1, dir=1, searching for 7 atoms
dim=1, dir=1, searching for 13 atoms
dim=1, dir=1, searching for 7 atoms
dim=1, dir=1, searching for 5 atoms
dim=1, dir=1, searching for 0 atoms
dim=1, dir=1, searching for 4 atoms
dim=1, dir=1, searching for 9 atoms
dim=1, dir=1, searching for 21 atoms
dim=1, dir=1, searching for 17 atoms
dim=1, dir=1, searching for 3 atoms
dim=1, dir=1, searching for 0 atoms
dim=1, dir=1, searching for 6 atoms
dim=1, dir=1, searching for 3 atoms
dim=1, dir=1, searching for 24 atoms
dim=1, dir=1, searching for 25 atoms
dim=1, dir=1, searching for 13 atoms
dim=1, dir=1, searching for 7 atoms
dim=1, dir=1, searching for 7 atoms
dim=1, dir=1, searching for 0 atoms
Send to node 13, 4 (4) indices, receive from node 9, 7 (7) indices
Send to node 5, 0 (0) indices, receive from node 1, 1 (1) indices
Send to node 29, 0 (0) indices, receive from node 25, 0 (0) indices
Send to node 21, 0 (0) indices, receive from node 17, 4 (4) indices
Send to node 25, 0 (0) indices, receive from node 29, 0 (0) indices
Send to node 27, 0 (0) indices, receive from node 31, 0 (0) indices
Send to node 31, 0 (0) indices, receive from node 27, 0 (0) indices
Send to node 7, 0 (0) indices, receive from node 3, 0 (0) indices
Send to node 1, 0 (0) indices, receive from node 5, 0 (0) indices
Send to node 3, 1 (1) indices, receive from node 7, 0 (0) indices
Send to node 9, 0 (0) indices, receive from node 13, 0 (0) indices
Send to node 11, 7 (7) indices, receive from node 15, 0 (0) indices
Send to node 15, 0 (0) indices, receive from node 11, 4 (4) indices
Send to node 19, 4 (4) indices, receive from node 23, 0 (0) indices
Send to node 23, 0 (0) indices, receive from node 19, 0 (0) indices
Send to node 17, 0 (0) indices, receive from node 21, 0 (0) indices
Send to node 28, 1 (1) indices, receive from node 24, 0 (0) indices
Send to node 4, 0 (0) indices, receive from node 0, 0 (0) indices
Send to node 12, 1 (1) indices, receive from node 8, 0 (0) indices
Send to node 20, 6 (6) indices, receive from node 16, 1 (1) indices
Send to node 10, 0 (0) indices, receive from node 14, 0 (0) indices
Send to node 8, 0 (0) indices, receive from node 12, 2 (2) indices
Send to node 14, 2 (2) indices, receive from node 10, 1 (1) indices
Send to node 6, 0 (0) indices, receive from node 2, 0 (0) indices
Send to node 2, 0 (0) indices, receive from node 6, 0 (0) indices
Send to node 0, 0 (0) indices, receive from node 4, 0 (0) indices
Send to node 16, 0 (0) indices, receive from node 20, 5 (5) indices
Send to node 22, 5 (5) indices, receive from node 18, 6 (6) indices
Send to node 18, 1 (1) indices, receive from node 22, 0 (0) indices
Send to node 26, 0 (0) indices, receive from node 30, 0 (0) indices
Send to node 24, 0 (0) indices, receive from node 28, 0 (0) indices
Send to node 30, 0 (0) indices, receive from node 26, 1 (1) indices
dim=1, dir=0, searching for 0 atoms
dim=1, dir=0, searching for 3 atoms
dim=1, dir=0, searching for 5 atoms
dim=1, dir=0, searching for 6 atoms
dim=1, dir=0, searching for 3 atoms
dim=1, dir=0, searching for 0 atoms
dim=1, dir=0, searching for 7 atoms
dim=1, dir=0, searching for 0 atoms
dim=1, dir=0, searching for 21 atoms
dim=1, dir=0, searching for 4 atoms
dim=1, dir=0, searching for 24 atoms
dim=1, dir=0, searching for 13 atoms
dim=1, dir=0, searching for 9 atoms
dim=1, dir=0, searching for 7 atoms
dim=1, dir=0, searching for 25 atoms
dim=1, dir=0, searching for 17 atoms
dim=1, dir=0, searching for 7 atoms
dim=1, dir=0, searching for 4 atoms
dim=1, dir=0, searching for 13 atoms
dim=1, dir=0, searching for 21 atoms
dim=1, dir=0, searching for 24 atoms
dim=1, dir=0, searching for 3 atoms
dim=1, dir=0, searching for 0 atoms
dim=1, dir=0, searching for 0 atoms
dim=1, dir=0, searching for 25 atoms
dim=1, dir=0, searching for 17 atoms
dim=1, dir=0, searching for 9 atoms
dim=1, dir=0, searching for 7 atoms
dim=1, dir=0, searching for 5 atoms
dim=1, dir=0, searching for 3 atoms
dim=1, dir=0, searching for 6 atoms
dim=1, dir=0, searching for 0 atoms
Send to node 31, 0 (0) indices, receive from node 27, 0 (0) indices
Send to node 25, 0 (0) indices, receive from node 29, 0 (0) indices
Send to node 27, 0 (0) indices, receive from node 31, 0 (0) indices
Send to node 29, 0 (0) indices, receive from node 25, 0 (0) indices
Send to node 3, 0 (0) indices, receive from node 7, 0 (0) indices
Send to node 1, 1 (1) indices, receive from node 5, 0 (0) indices
Send to node 7, 0 (0) indices, receive from node 3, 1 (1) indices
Send to node 5, 0 (0) indices, receive from node 1, 0 (0) indices
Send to node 13, 0 (0) indices, receive from node 9, 0 (0) indices
Send to node 15, 0 (0) indices, receive from node 11, 9 (9) indices
Send to node 9, 9 (9) indices, receive from node 13, 5 (5) indices
Send to node 11, 5 (5) indices, receive from node 15, 0 (0) indices
Send to node 17, 4 (4) indices, receive from node 21, 0 (0) indices
Send to node 23, 0 (0) indices, receive from node 19, 4 (4) indices
Send to node 19, 0 (0) indices, receive from node 23, 0 (0) indices
Send to node 21, 0 (0) indices, receive from node 17, 0 (0) indices
Send to node 14, 0 (0) indices, receive from node 10, 0 (0) indices
Send to node 12, 2 (2) indices, receive from node 8, 0 (0) indices
Send to node 8, 0 (0) indices, receive from node 12, 1 (1) indices
Send to node 10, 1 (1) indices, receive from node 14, 2 (2) indices
Send to node 0, 0 (0) indices, receive from node 4, 0 (0) indices
Send to node 2, 0 (0) indices, receive from node 6, 0 (0) indices
Send to node 4, 0 (0) indices, receive from node 0, 0 (0) indices
Send to node 6, 0 (0) indices, receive from node 2, 0 (0) indices
Send to node 20, 5 (5) indices, receive from node 16, 0 (0) indices
Send to node 22, 0 (0) indices, receive from node 18, 1 (1) indices
Send to node 16, 1 (1) indices, receive from node 20, 5 (5) indices
Send to node 18, 5 (5) indices, receive from node 22, 5 (5) indices
Send to node 28, 0 (0) indices, receive from node 24, 0 (0) indices
Send to node 26, 2 (2) indices, receive from node 30, 0 (0) indices
Send to node 30, 0 (0) indices, receive from node 26, 0 (0) indices
Send to node 24, 0 (0) indices, receive from node 28, 2 (2) indices
dim=2, dir=0, searching for 0 atoms
dim=2, dir=0, searching for 6 atoms
dim=2, dir=0, searching for 3 atoms
dim=2, dir=0, searching for 5 atoms
dim=2, dir=0, searching for 0 atoms
dim=2, dir=0, searching for 0 atoms
dim=2, dir=0, searching for 0 atoms
dim=2, dir=0, searching for 0 atoms
dim=2, dir=0, searching for 3 atoms
dim=2, dir=0, searching for 0 atoms
dim=2, dir=0, searching for 2 atoms
dim=2, dir=0, searching for 12 atoms
dim=2, dir=0, searching for 14 atoms
dim=2, dir=0, searching for 2 atoms
dim=2, dir=0, searching for 17 atoms
dim=2, dir=0, searching for 9 atoms
dim=2, dir=0, searching for 13 atoms
dim=2, dir=0, searching for 9 atoms
dim=2, dir=0, searching for 22 atoms
dim=2, dir=0, searching for 1 atoms
dim=2, dir=0, searching for 3 atoms
dim=2, dir=0, searching for 0 atoms
dim=2, dir=0, searching for 0 atoms
dim=2, dir=0, searching for 7 atoms
dim=2, dir=0, searching for 5 atoms
dim=2, dir=0, searching for 0 atoms
dim=2, dir=0, searching for 11 atoms
dim=2, dir=0, searching for 0 atoms
dim=2, dir=0, searching for 0 atoms
dim=2, dir=0, searching for 0 atoms
dim=2, dir=0, searching for 0 atoms
dim=2, dir=0, searching for 0 atoms
Send to node 8, 0 (0) indices, receive from node 8, 0 (0) indices
Send to node 9, 0 (0) indices, receive from node 9, 0 (0) indices
Send to node 12, 6 (6) indices, receive from node 12, 5 (5) indices
Send to node 11, 2 (2) indices, receive from node 11, 1 (1) indices
Send to node 13, 5 (5) indices, receive from node 13, 6 (6) indices
Send to node 10, 1 (1) indices, receive from node 10, 2 (2) indices
Send to node 14, 1 (1) indices, receive from node 14, 1 (1) indices
Send to node 15, 1 (1) indices, receive from node 15, 1 (1) indices
Send to node 3, 0 (0) indices, receive from node 3, 0 (0) indices
Send to node 2, 0 (0) indices, receive from node 2, 0 (0) indices
Send to node 5, 0 (0) indices, receive from node 5, 0 (0) indices
Send to node 4, 0 (0) indices, receive from node 4, 0 (0) indices
Send to node 6, 0 (0) indices, receive from node 6, 0 (0) indices
Send to node 7, 0 (0) indices, receive from node 7, 0 (0) indices
Send to node 1, 0 (0) indices, receive from node 1, 0 (0) indices
Send to node 0, 0 (0) indices, receive from node 0, 0 (0) indices
Send to node 16, 1 (1) indices, receive from node 16, 1 (1) indices
Send to node 17, 1 (1) indices, receive from node 17, 1 (1) indices
Send to node 23, 0 (0) indices, receive from node 23, 0 (0) indices
Send to node 22, 0 (0) indices, receive from node 22, 0 (0) indices
Send to node 19, 3 (3) indices, receive from node 19, 4 (4) indices
Send to node 18, 4 (4) indices, receive from node 18, 3 (3) indices
Send to node 21, 0 (0) indices, receive from node 21, 0 (0) indices
Send to node 20, 0 (0) indices, receive from node 20, 0 (0) indices
Send to node 31, 0 (0) indices, receive from node 31, 0 (0) indices
Send to node 30, 0 (0) indices, receive from node 30, 0 (0) indices
Send to node 25, 0 (0) indices, receive from node 25, 0 (0) indices
Send to node 24, 0 (0) indices, receive from node 24, 0 (0) indices
Send to node 27, 0 (0) indices, receive from node 27, 0 (0) indices
Send to node 26, 0 (0) indices, receive from node 26, 0 (0) indices
Send to node 29, 0 (0) indices, receive from node 29, 0 (0) indices
Send to node 28, 0 (0) indices, receive from node 28, 0 (0) indices
Done setup_specat_communication
Done setup_specat_communication
Done setup_specat_communication
Done setup_specat_communication
Done setup_specat_communication
Done setup_specat_communication
Done setup_specat_communication
Done setup_specat_communication
Done setup_specat_communication
Done setup_specat_communication
Done setup_specat_communication
Done setup_specat_communication
Done setup_specat_communication
Done setup_specat_communication
Done setup_specat_communication
Done setup_specat_communication
Done setup_specat_communication
Done setup_specat_communication
Done setup_specat_communication
Done setup_specat_communication
Done setup_specat_communication
Done setup_specat_communication
Done setup_specat_communication
Done setup_specat_communication
Done setup_specat_communication
Done setup_specat_communication
Done setup_specat_communication
Done setup_specat_communication
Done setup_specat_communication
Done setup_specat_communication
Done setup_specat_communication
Done setup_specat_communication
Reallocating state: currently 1945, required 3341, allocating 4075
Reallocating state: currently 1831, required 3123, allocating 3816
Reallocating state: currently 1980, required 3257, allocating 3975
Reallocating state: currently 1887, required 3394, allocating 4138
Reallocating state: currently 2171, required 3520, allocating 4288
Reallocating state: currently 1799, required 3197, allocating 3904
Reallocating state: currently 1860, required 3179, allocating 3883
Reallocating state: currently 1860, required 3070, allocating 3753
Reallocating state: currently 1826, required 3028, allocating 3703
Reallocating state: currently 1844, required 3201, allocating 3909
Reallocating state: currently 1840, required 3070, allocating 3753
Reallocating state: currently 1819, required 3108, allocating 3798
Reallocating state: currently 1838, required 3072, allocating 3755
Reallocating state: currently 1843, required 3069, allocating 3752
Reallocating state: currently 1840, required 3060, allocating 3741
Reallocating state: currently 1839, required 3197, allocating 3904
Reallocating state: currently 1855, required 3172, allocating 3874
Reallocating state: currently 1854, required 3143, allocating 3840
Reallocating state: currently 2008, required 3294, allocating 4019
Reallocating state: currently 1850, required 3106, allocating 3796
Reallocating state: currently 1957, required 3202, allocating 3910
Reallocating state: currently 1993, required 3401, allocating 4147
Reallocating state: currently 2117, required 3551, allocating 4325
Reallocating state: currently 1871, required 3134, allocating 3829
Reallocating state: currently 1876, required 3133, allocating 3828
Reallocating state: currently 1838, required 3078, allocating 3762
Reallocating state: currently 1848, required 3095, allocating 3783
Reallocating state: currently 1815, required 3061, allocating 3742
Reallocating state: currently 1821, required 3121, allocating 3813
Reallocating state: currently 1831, required 3055, allocating 3735
Reallocating state: currently 1912, required 3191, allocating 3897
Reallocating state: currently 1831, required 3091, allocating 3778
Building the LINCS connectivity
Number of constraints is 67, couplings 78
Of the 67 constraints 39 participate in triangles
There are 78 couplings of which 78 in triangles
vcm: start=0, homenr=1551, end=1551
vcm: start=0, homenr=1455, end=1455
Building the LINCS connectivity
Building the LINCS connectivity
Number of constraints is 48, couplings 42
Of the 48 constraints 21 participate in triangles
There are 42 couplings of which 42 in triangles
vcm: start=0, homenr=1502, end=1502
Building the LINCS connectivity
Building the LINCS connectivity
Building the LINCS connectivity
Building the LINCS connectivity
Building the LINCS connectivity
vcm: start=0, homenr=1451, end=1451
Building the LINCS connectivity
vcm: start=0, homenr=1463, end=1463
vcm: start=0, homenr=1461, end=1461
Building the LINCS connectivity
vcm: start=0, homenr=1465, end=1465
Building the LINCS connectivity
Building the LINCS connectivity
Building the LINCS connectivity
vcm: start=0, homenr=1463, end=1463
Building the LINCS connectivity
vcm: start=0, homenr=1471, end=1471
Building the LINCS connectivity
Building the LINCS connectivity
vcm: start=0, homenr=1461, end=1461
vcm: start=0, homenr=1469, end=1469
vcm: start=0, homenr=1442, end=1442
Building the LINCS connectivity
Building the LINCS connectivity
Building the LINCS connectivity
Building the LINCS connectivity
vcm: start=0, homenr=1455, end=1455
Number of constraints is 84, couplings 84
Of the 84 constraints 42 participate in triangles
There are 84 couplings of which 84 in triangles
vcm: start=0, homenr=1455, end=1455
vcm: start=0, homenr=1580, end=1580
Number of constraints is 1, couplings 0
Of the 1 constraints 0 participate in triangles
There are 0 couplings of which 0 in triangles
Number of constraints is 24, couplings 30
Of the 24 constraints 15 participate in triangles
There are 30 couplings of which 30 in triangles
vcm: start=0, homenr=1479, end=1479
vcm: start=0, homenr=1479, end=1479
Number of constraints is 8, couplings 0
Number of constraints is 15, couplings 12
Number of constraints is 5, couplings 0
Of the 8 constraints 0 participate in triangles
Of the 15 constraints 6 participate in triangles
Of the 5 constraints 0 participate in triangles
Number of constraints is 169, couplings 138
There are 0 couplings of which 0 in triangles
Number of constraints is 5, couplings 6
There are 12 couplings of which 12 in triangles
There are 0 couplings of which 0 in triangles
Of the 169 constraints 69 participate in triangles
Of the 5 constraints 3 participate in triangles
vcm: start=0, homenr=1466, end=1466
There are 138 couplings of which 138 in triangles
There are 6 couplings of which 6 in triangles
Number of constraints is 34, couplings 42
vcm: start=0, homenr=1428, end=1428
Number of constraints is 21, couplings 36
vcm: start=0, homenr=1475, end=1475
Number of constraints is 77, couplings 84
Of the 34 constraints 21 participate in triangles
vcm: start=0, homenr=1741, end=1741
Of the 21 constraints 18 participate in triangles
vcm: start=0, homenr=1445, end=1445
Of the 77 constraints 42 participate in triangles
Number of constraints is 96, couplings 84
There are 42 couplings of which 42 in triangles
Number of constraints is 63, couplings 84
There are 36 couplings of which 36 in triangles
Number of constraints is 162, couplings 132
There are 84 couplings of which 84 in triangles
Of the 96 constraints 42 participate in triangles
Of the 63 constraints 42 participate in triangles
vcm: start=0, homenr=1462, end=1462
Number of constraints is 7, couplings 6
Of the 162 constraints 66 participate in triangles
Number of constraints is 16, couplings 24
There are 84 couplings of which 84 in triangles
vcm: start=0, homenr=1474, end=1474
Number of constraints is 10, couplings 18
There are 84 couplings of which 84 in triangles
vcm: start=0, homenr=1604, end=1604
Of the 7 constraints 3 participate in triangles
There are 132 couplings of which 132 in triangles
Number of constraints is 24, couplings 24
Of the 16 constraints 12 participate in triangles
vcm: start=0, homenr=1591, end=1591
Of the 10 constraints 9 participate in triangles
vcm: start=0, homenr=1561, end=1561
There are 6 couplings of which 6 in triangles
Of the 24 constraints 12 participate in triangles
vcm: start=0, homenr=1695, end=1695
There are 24 couplings of which 24 in triangles
There are 18 couplings of which 18 in triangles
There are 24 couplings of which 24 in triangles
vcm: start=0, homenr=1489, end=1489
vcm: start=0, homenr=1493, end=1493
vcm: start=0, homenr=1447, end=1447
vcm: start=0, homenr=1523, end=1523
Summing 28 energies
Summing 28 energies
Summing 28 energies
Summing 28 energies
Summing 28 energies
Summing 28 energies
Summing 28 energies
Summing 28 energies
Summing 28 energies
Summing 28 energies
Summing 28 energies
Summing 28 energies
Summing 28 energies
Summing 28 energies
Summing 28 energies
Summing 28 energies
Summing 28 energies
Summing 28 energies
Summing 28 energies
Summing 28 energies
Summing 28 energies
Summing 28 energies
Summing 28 energies
Summing 28 energies
Summing 28 energies
Summing 28 energies
Summing 28 energies
Summing 28 energies
Summing 28 energies
Summing 28 energies
Summing 28 energies
Summing 28 energies
dekin (3x3):
dekin (3x3):
dekin (3x3):
dekin (3x3):
dekin (3x3):
dekin (3x3):
dekin (3x3):
 dekin (3x3):
dekin (3x3):
dekin (3x3):
dekin (3x3):
dekin (3x3):
dekin (3x3):
dekin (3x3):
dekin (3x3):
dekin (3x3):
dekin (3x3):
 dekin (3x3):
dekin (3x3):
dekin (3x3):
 dekin (3x3):
dekin (3x3):
dekin (3x3):
dekin (3x3):
 dekin (3x3):
dekin (3x3):
dekin (3x3):
dekin (3x3):
dekin (3x3):
 dekin (3x3):
dekin (3x3):
dekin (3x3):
                                                                  dekin[    0]={          dekin[    0]={   dekin[    0]={    dekin[    0]={     dekin[    0]={   dekin[    0]={dekin[    0]={ 2.25152e-19dekin[    0]={dekin[    0]={dekin[    0]={dekin[    0]={dekin[    0]={dekin[    0]={dekin[    0]={dekin[    0]={dekin[    0]={dekin[    0]={-2.37133e-19dekin[    0]={dekin[    0]={dekin[    0]={-9.99313e-20dekin[    0]={dekin[    0]={dekin[    0]={dekin[    0]={-1.30667e-19dekin[    0]={dekin[    0]={dekin[    0]={dekin[    0]={dekin[    0]={ 4.82518e-28dekin[    0]={dekin[    0]={dekin[    0]={ 4.78207e-28-1.53072e-19,  3.69427e-19 2.96295e-20 6.37104e-27 4.82518e-28-1.87171e-20 2.91140e-20 4.82518e-28 4.81192e-28 4.85171e-28 4.84508e-28,  4.84508e-28 4.87824e-28-6.78127e-20,  1.65523e-19 4.87161e-28 3.15467e-19-1.12379e-20, -3.20038e-20 4.85835e-28 1.93401e-19-2.48315e-19 4.85171e-28, -5.75555e-20-2.71268e-19 2.33474e-27, ,  4.32342e-19, , , , , , , , , , -4.55347e-19, , , -1.91890e-19, , , , -2.50910e-19, , , , ,  9.26541e-28, , ,  9.18263e-28-2.93933e-19,  7.09382e-19 5.68952e-20 1.22338e-26 9.26541e-28-3.59410e-20 5.59053e-20 9.26541e-28 9.23994e-28 9.31636e-28 9.30362e-28,  9.30362e-28 9.36730e-28-1.30215e-19,  3.17840e-19 9.35456e-28 6.05766e-19-2.15792e-20, -6.14543e-20 9.32909e-28 3.71373e-19-4.76820e-19 9.31636e-28, -1.10519e-19-5.20894e-19 4.48321e-27, ,  6.70812e-19, , , , , , , , , , -7.06505e-19, , , -2.97732e-19, , , , -3.89306e-19, , , , ,  1.43760e-27, , ,  1.42475e-27-4.56059e-19}
 1.10066e-18 8.82772e-20 1.89817e-26 1.43760e-27-5.57652e-20 8.67414e-20 1.43760e-27 1.43365e-27 1.44550e-27 1.44353e-27}
 1.44353e-27 1.45341e-27-2.02039e-19}
 4.93153e-19 1.45143e-27 9.39892e-19-3.34817e-20}
-9.53510e-20 1.44748e-27 5.76213e-19-7.39822e-19 1.44550e-27}
-1.71479e-19-8.08207e-19 6.95603e-27}
}
 }
}
}
}
}
}
}
}
}
}
 }
}
}
 }
}
}
}
 }
}
}
}
}
 }
}
}
                                                                  dekin[    1]={          dekin[    1]={   dekin[    1]={    dekin[    1]={     dekin[    1]={   dekin[    1]={dekin[    1]={-4.39628e-20dekin[    1]={dekin[    1]={dekin[    1]={dekin[    1]={dekin[    1]={dekin[    1]={dekin[    1]={dekin[    1]={dekin[    1]={dekin[    1]={ 2.27844e-19dekin[    1]={dekin[    1]={dekin[    1]={-1.39443e-19dekin[    1]={dekin[    1]={dekin[    1]={dekin[    1]={-2.62122e-19dekin[    1]={dekin[    1]={dekin[    1]={dekin[    1]={dekin[    1]={ 9.26541e-28dekin[    1]={dekin[    1]={dekin[    1]={ 9.18263e-28 1.80158e-19, -6.97956e-20 5.94835e-19 9.19457e-28 9.26541e-28-4.27201e-19 1.09372e-19 9.26541e-28 9.23994e-28 9.31636e-28 9.30362e-28,  9.30362e-28 9.36730e-28-2.25959e-19, -2.95892e-20 9.35456e-28 1.44677e-19 2.42853e-20, -1.12660e-19 9.32909e-28 6.70936e-19 1.41286e-21 9.31636e-28,  1.34801e-19-7.77589e-19 9.47476e-28, , -8.44183e-20, , , , , , , , , ,  4.37511e-19, , , -2.67761e-19, , , , -5.03331e-19, , , , ,  1.77916e-27, , ,  1.76327e-27 3.45942e-19, -1.34023e-19 1.14221e-18 1.76556e-27 1.77916e-27-8.20321e-19 2.10018e-19 1.77916e-27 1.77427e-27 1.78895e-27 1.78650e-27,  1.78650e-27 1.79873e-27-4.33892e-19, -5.68178e-20 1.79628e-27 2.77813e-19 4.66331e-20, -2.16332e-19 1.79139e-27 1.28835e-18 2.71300e-21 1.78895e-27,  2.58848e-19-1.49314e-18 1.81936e-27, , -1.30981e-19, , , , , , , , , ,  6.78831e-19, , , -4.15452e-19, , , , -7.80957e-19, , , , ,  2.76051e-27, , ,  2.73584e-27 5.36756e-19}
-2.07947e-19 1.77223e-18 2.73940e-27 2.76051e-27-1.27279e-18 3.25859e-19 2.76051e-27 2.75292e-27 2.77568e-27 2.77189e-27}
 2.77189e-27 2.79086e-27-6.73216e-19}
-8.81572e-20 2.78707e-27 4.31047e-19 7.23549e-20}
-3.35656e-19 2.77948e-27 1.99897e-18 4.20943e-21 2.77568e-27}
 4.01623e-19-2.31672e-18 2.82288e-27}
}
 }
}
}
}
}
}
}
}
}
}
 }
}
}
 }
}
}
}
 }
}
}
}
}
 }
}
}
                                                                  dekin[    2]={          dekin[    2]={   dekin[    2]={    dekin[    2]={     dekin[    2]={   dekin[    2]={dekin[    2]={ 1.44045e-19dekin[    2]={dekin[    2]={dekin[    2]={dekin[    2]={dekin[    2]={dekin[    2]={dekin[    2]={dekin[    2]={dekin[    2]={dekin[    2]={-2.68536e-20dekin[    2]={dekin[    2]={dekin[    2]={-3.47826e-20dekin[    2]={dekin[    2]={dekin[    2]={dekin[    2]={ 5.43335e-19dekin[    2]={dekin[    2]={dekin[    2]={dekin[    2]={dekin[    2]={ 1.43760e-27dekin[    2]={dekin[    2]={dekin[    2]={ 1.42475e-27 2.46030e-19, -1.01905e-19-3.71386e-19 9.28288e-27 1.43760e-27-3.02424e-20 1.00104e-19 1.43760e-27 1.43365e-27 1.44550e-27 1.44353e-27,  1.44353e-27 1.45341e-27-9.66246e-20, -3.64126e-19 1.45143e-27-2.83556e-19 6.04484e-20,  4.91080e-20 1.44748e-27-1.68112e-19 9.44475e-21 1.44550e-27,  1.37076e-19 1.87997e-19 1.47008e-27, ,  2.76598e-19, , , , , , , , , , -5.15648e-20, , , -6.67903e-20, , , ,  1.04332e-18, , , , ,  2.76051e-27, , ,  2.73584e-27 4.72433e-19, -1.95680e-19-7.13143e-19 1.78252e-26 2.76051e-27-5.80721e-20 1.92222e-19 2.76051e-27 2.75292e-27 2.77568e-27 2.77189e-27,  2.77189e-27 2.79086e-27-1.85541e-19, -6.99203e-19 2.78707e-27-5.44490e-19 1.16074e-19,  9.42982e-20 2.77948e-27-3.22812e-19 1.81360e-20 2.77568e-27,  2.63216e-19 3.60996e-19 2.82288e-27, ,  4.29163e-19, , , , , , , , , , -8.00068e-20, , , -1.03630e-19, , , ,  1.61879e-18, , , , ,  4.28314e-27, , ,  4.24487e-27 7.33015e-19}
-3.03613e-19-1.10650e-18 2.76571e-26 4.28314e-27-9.01033e-20 2.98247e-19 4.28314e-27 4.27136e-27 4.30669e-27 4.30080e-27}
 4.30080e-27 4.33024e-27-2.87880e-19}
-1.08487e-18 4.32435e-27-8.44817e-19 1.80098e-19}
 1.46311e-19 4.31257e-27-5.00867e-19 2.81394e-20 4.30669e-27}
 4.08399e-19 5.60113e-19 4.37991e-27}
}
 ekin (3x3):
}
}
}
}
}
}
}
}
}
}
 ekin (3x3):
}
}
}
 ekin (3x3):
}
}
}
}
 ekin (3x3):
}
}
}
}
}
 ekin (3x3):
}
}
}
 ekin (3x3):
 ekin (3x3):
  ekin (3x3):
 ekin (3x3):
 ekin (3x3):
 ekin (3x3):
 ekin (3x3):
 ekin (3x3):
 ekin (3x3):
 ekin (3x3):
 ekin (3x3):
 ekin (3x3):
  ekin (3x3):
 ekin (3x3):
 ekin (3x3):
  ekin (3x3):
 ekin (3x3):
 ekin (3x3):
 ekin (3x3):
  ekin (3x3):
 ekin (3x3):
 ekin (3x3):
 ekin (3x3):
 ekin (3x3):
  ekin (3x3):
 ekin (3x3):
 ekin (3x3):
                                                                   ekin[    0]={           ekin[    0]={    ekin[    0]={     ekin[    0]={      ekin[    0]={    ekin[    0]={ ekin[    0]={ 0.00000e+00 ekin[    0]={ ekin[    0]={ ekin[    0]={ ekin[    0]={ ekin[    0]={ ekin[    0]={ ekin[    0]={ ekin[    0]={ ekin[    0]={ ekin[    0]={ 0.00000e+00 ekin[    0]={ ekin[    0]={ ekin[    0]={ 0.00000e+00 ekin[    0]={ ekin[    0]={ ekin[    0]={ ekin[    0]={ 0.00000e+00 ekin[    0]={ ekin[    0]={ ekin[    0]={ ekin[    0]={ ekin[    0]={ 0.00000e+00 ekin[    0]={ ekin[    0]={ ekin[    0]={ 0.00000e+00 0.00000e+00,  0.00000e+00 0.00000e+00 0.00000e+00 0.00000e+00 0.00000e+00 0.00000e+00 0.00000e+00 0.00000e+00 0.00000e+00 0.00000e+00,  0.00000e+00 0.00000e+00 0.00000e+00,  0.00000e+00 0.00000e+00 0.00000e+00 0.00000e+00,  0.00000e+00 0.00000e+00 0.00000e+00 0.00000e+00 0.00000e+00,  0.00000e+00 0.00000e+00 0.00000e+00, ,  0.00000e+00, , , , , , , , , ,  0.00000e+00, , ,  0.00000e+00, , , ,  0.00000e+00, , , , ,  0.00000e+00, , ,  0.00000e+00 0.00000e+00,  0.00000e+00 0.00000e+00 0.00000e+00 0.00000e+00 0.00000e+00 0.00000e+00 0.00000e+00 0.00000e+00 0.00000e+00 0.00000e+00,  0.00000e+00 0.00000e+00 0.00000e+00,  0.00000e+00 0.00000e+00 0.00000e+00 0.00000e+00,  0.00000e+00 0.00000e+00 0.00000e+00 0.00000e+00 0.00000e+00,  0.00000e+00 0.00000e+00 0.00000e+00, ,  0.00000e+00, , , , , , , , , ,  0.00000e+00, , ,  0.00000e+00, , , ,  0.00000e+00, , , , ,  0.00000e+00, , ,  0.00000e+00 0.00000e+00}
 0.00000e+00 0.00000e+00 0.00000e+00 0.00000e+00 0.00000e+00 0.00000e+00 0.00000e+00 0.00000e+00 0.00000e+00 0.00000e+00}
 0.00000e+00 0.00000e+00 0.00000e+00}
 0.00000e+00 0.00000e+00 0.00000e+00 0.00000e+00}
 0.00000e+00 0.00000e+00 0.00000e+00 0.00000e+00 0.00000e+00}
 0.00000e+00 0.00000e+00 0.00000e+00}
}
 }
}
}
}
}
}
}
}
}
}
 }
}
}
 }
}
}
}
 }
}
}
}
}
 }
}
}
                                                                   ekin[    1]={           ekin[    1]={    ekin[    1]={     ekin[    1]={      ekin[    1]={    ekin[    1]={ ekin[    1]={ 0.00000e+00 ekin[    1]={ ekin[    1]={ ekin[    1]={ ekin[    1]={ ekin[    1]={ ekin[    1]={ ekin[    1]={ ekin[    1]={ ekin[    1]={ ekin[    1]={ 0.00000e+00 ekin[    1]={ ekin[    1]={ ekin[    1]={ 0.00000e+00 ekin[    1]={ ekin[    1]={ ekin[    1]={ ekin[    1]={ 0.00000e+00 ekin[    1]={ ekin[    1]={ ekin[    1]={ ekin[    1]={ ekin[    1]={ 0.00000e+00 ekin[    1]={ ekin[    1]={ ekin[    1]={ 0.00000e+00 0.00000e+00,  0.00000e+00 0.00000e+00 0.00000e+00 0.00000e+00 0.00000e+00 0.00000e+00 0.00000e+00 0.00000e+00 0.00000e+00 0.00000e+00,  0.00000e+00 0.00000e+00 0.00000e+00,  0.00000e+00 0.00000e+00 0.00000e+00 0.00000e+00,  0.00000e+00 0.00000e+00 0.00000e+00 0.00000e+00 0.00000e+00,  0.00000e+00 0.00000e+00 0.00000e+00, ,  0.00000e+00, , , , , , , , , ,  0.00000e+00, , ,  0.00000e+00, , , ,  0.00000e+00, , , , ,  0.00000e+00, , ,  0.00000e+00 0.00000e+00,  0.00000e+00 0.00000e+00 0.00000e+00 0.00000e+00 0.00000e+00 0.00000e+00 0.00000e+00 0.00000e+00 0.00000e+00 0.00000e+00,  0.00000e+00 0.00000e+00 0.00000e+00,  0.00000e+00 0.00000e+00 0.00000e+00 0.00000e+00,  0.00000e+00 0.00000e+00 0.00000e+00 0.00000e+00 0.00000e+00,  0.00000e+00 0.00000e+00 0.00000e+00, ,  0.00000e+00, , , , , , , , , ,  0.00000e+00, , ,  0.00000e+00, , , ,  0.00000e+00, , , , ,  0.00000e+00, , ,  0.00000e+00 0.00000e+00}
 0.00000e+00 0.00000e+00 0.00000e+00 0.00000e+00 0.00000e+00 0.00000e+00 0.00000e+00 0.00000e+00 0.00000e+00 0.00000e+00}
 0.00000e+00 0.00000e+00 0.00000e+00}
 0.00000e+00 0.00000e+00 0.00000e+00 0.00000e+00}
 0.00000e+00 0.00000e+00 0.00000e+00 0.00000e+00 0.00000e+00}
 0.00000e+00 0.00000e+00 0.00000e+00}
}
 }
}
}
}
}
}
}
}
}
}
 }
}
}
 }
}
}
}
 }
}
}
}
}
 }
}
}
                                                                   ekin[    2]={           ekin[    2]={    ekin[    2]={     ekin[    2]={      ekin[    2]={    ekin[    2]={ ekin[    2]={ 0.00000e+00 ekin[    2]={ ekin[    2]={ ekin[    2]={ ekin[    2]={ ekin[    2]={ ekin[    2]={ ekin[    2]={ ekin[    2]={ ekin[    2]={ ekin[    2]={ 0.00000e+00 ekin[    2]={ ekin[    2]={ ekin[    2]={ 0.00000e+00 ekin[    2]={ ekin[    2]={ ekin[    2]={ ekin[    2]={ 0.00000e+00 ekin[    2]={ ekin[    2]={ ekin[    2]={ ekin[    2]={ ekin[    2]={ 0.00000e+00 ekin[    2]={ ekin[    2]={ ekin[    2]={ 0.00000e+00 0.00000e+00,  0.00000e+00 0.00000e+00 0.00000e+00 0.00000e+00 0.00000e+00 0.00000e+00 0.00000e+00 0.00000e+00 0.00000e+00 0.00000e+00,  0.00000e+00 0.00000e+00 0.00000e+00,  0.00000e+00 0.00000e+00 0.00000e+00 0.00000e+00,  0.00000e+00 0.00000e+00 0.00000e+00 0.00000e+00 0.00000e+00,  0.00000e+00 0.00000e+00 0.00000e+00, ,  0.00000e+00, , , , , , , , , ,  0.00000e+00, , ,  0.00000e+00, , , ,  0.00000e+00, , , , ,  0.00000e+00, , ,  0.00000e+00 0.00000e+00,  0.00000e+00 0.00000e+00 0.00000e+00 0.00000e+00 0.00000e+00 0.00000e+00 0.00000e+00 0.00000e+00 0.00000e+00 0.00000e+00,  0.00000e+00 0.00000e+00 0.00000e+00,  0.00000e+00 0.00000e+00 0.00000e+00 0.00000e+00,  0.00000e+00 0.00000e+00 0.00000e+00 0.00000e+00 0.00000e+00,  0.00000e+00 0.00000e+00 0.00000e+00, ,  0.00000e+00, , , , , , , , , ,  0.00000e+00, , ,  0.00000e+00, , , ,  0.00000e+00, , , , ,  0.00000e+00, , ,  0.00000e+00 0.00000e+00}
 0.00000e+00 0.00000e+00 0.00000e+00 0.00000e+00 0.00000e+00 0.00000e+00 0.00000e+00 0.00000e+00 0.00000e+00 0.00000e+00}
 0.00000e+00 0.00000e+00 0.00000e+00}
 0.00000e+00 0.00000e+00 0.00000e+00 0.00000e+00}
 0.00000e+00 0.00000e+00 0.00000e+00 0.00000e+00 0.00000e+00}
 0.00000e+00 0.00000e+00 0.00000e+00}
}
dekin = 5.69897e-19, ekin = 0  vcm = (  0.0000   0.0000   0.0000)
}
}
}
}
}
}
}
}
}
}
dekin = 1.20371e-19, ekin = 0  vcm = (  0.0000   0.0000   0.0000)
}
}
}
dekin = -4.71323e-19, ekin = 0  vcm = (  0.0000   0.0000   0.0000)
}
}
}
}
dekin = 9.84796e-19, ekin = 0  vcm = (  0.0000   0.0000   0.0000)
}
}
}
}
}
dekin = 6.54482e-27, ekin = 0  vcm = (  0.0000   0.0000   0.0000)
}
}
}
dekin = 6.48634e-27, ekin = 0  vcm = (  0.0000   0.0000   0.0000)
dekin = 9.25885e-19, ekin = 0  vcm = (  0.0000   0.0000   0.0000)
mv = ( -0.0023   0.0005  -0.0015)
dekin = -6.82084e-20, ekin = 0  vcm = (  0.0000   0.0000   0.0000)
dekin = 6.53491e-20, ekin = 0  vcm = (  0.0000   0.0000   0.0000)
dekin = 3.57937e-26, ekin = 0  vcm = (  0.0000   0.0000   0.0000)
dekin = 6.54482e-27, ekin = 0  vcm = (  0.0000   0.0000   0.0000)
dekin = -9.29141e-19, ekin = 0  vcm = (  0.0000   0.0000   0.0000)
dekin = 5.37379e-19, ekin = 0  vcm = (  0.0000   0.0000   0.0000)
dekin = 6.54482e-27, ekin = 0  vcm = (  0.0000   0.0000   0.0000)
dekin = 6.52682e-27, ekin = 0  vcm = (  0.0000   0.0000   0.0000)
dekin = 6.5808e-27, ekin = 0  vcm = (  0.0000   0.0000   0.0000)
dekin = 6.57181e-27, ekin = 0  vcm = (  0.0000   0.0000   0.0000)
mv = (  0.0025  -0.0024   0.0003)
dekin = 6.57181e-27, ekin = 0  vcm = (  0.0000   0.0000   0.0000)
dekin = 6.61679e-27, ekin = 0  vcm = (  0.0000   0.0000   0.0000)
dekin = -7.89585e-19, ekin = 0  vcm = (  0.0000   0.0000   0.0000)
mv = (  0.0010   0.0015   0.0004)
dekin = -9.76161e-19, ekin = 0  vcm = (  0.0000   0.0000   0.0000)
dekin = 6.60779e-27, ekin = 0  vcm = (  0.0000   0.0000   0.0000)
dekin = -2.51538e-19, ekin = 0  vcm = (  0.0000   0.0000   0.0000)
dekin = 2.15493e-19, ekin = 0  vcm = (  0.0000   0.0000   0.0000)
mv = (  0.0014   0.0027  -0.0057)
dekin = -1.02025e-19, ekin = 0  vcm = (  0.0000   0.0000   0.0000)
dekin = 6.5898e-27, ekin = 0  vcm = (  0.0000   0.0000   0.0000)
dekin = 9.80879e-19, ekin = 0  vcm = (  0.0000   0.0000   0.0000)
dekin = -2.17463e-19, ekin = 0  vcm = (  0.0000   0.0000   0.0000)
dekin = 6.5808e-27, ekin = 0  vcm = (  0.0000   0.0000   0.0000)
mv = (  0.0000   0.0000   0.0000)
dekin = 6.09692e-19, ekin = 0  vcm = (  0.0000   0.0000   0.0000)
dekin = -1.2043e-18, ekin = 0  vcm = (  0.0000   0.0000   0.0000)
dekin = 8.53401e-27, ekin = 0  vcm = (  0.0000   0.0000   0.0000)
mv = (  0.0000   0.0000   0.0000)
mv = (  0.0016  -0.0019  -0.0026)
mv = ( -0.0038   0.0007   0.0011)
Hash table size 2048 #key 5: resizing
mv = ( -0.0003  -0.0062   0.0039)
mv = ( -0.0000   0.0000  -0.0000)
mv = (  0.0000   0.0000   0.0000)
mv = (  0.0002   0.0045   0.0003)
mv = ( -0.0003  -0.0011  -0.0010)
mv = (  0.0000   0.0000   0.0000)
mv = (  0.0000   0.0000   0.0000)
mv = (  0.0000   0.0000   0.0000)
mv = (  0.0000   0.0000   0.0000)
Hash table size 2048 #key 3: resizing
mv = (  0.0000   0.0000   0.0000)
mv = (  0.0000   0.0000   0.0000)
mv = (  0.0007   0.0024   0.0010)
Hash table size 2048 #key 13: resizing
mv = ( -0.0017   0.0003   0.0038)
mv = (  0.0000   0.0000   0.0000)
mv = ( -0.0033  -0.0015   0.0030)
mv = (  0.0001  -0.0003  -0.0006)
Hash table size 2048 #key 12: resizing
mv = (  0.0003   0.0012  -0.0005)
mv = (  0.0000   0.0000   0.0000)
mv = ( -0.0020  -0.0070   0.0018)
mv = (  0.0026  -0.0000  -0.0001)
mv = (  0.0000   0.0000   0.0000)
box[0]  19.700 0.000 0.000
mv = (  0.0006  -0.0014  -0.0014)
mv = (  0.0028   0.0081  -0.0020)
mv = ( -0.0000   0.0000   0.0000)
box[0]  19.700 0.000 0.000
Hash table size 2048 #key 6: resizing
Hash table mod 16 nalloc 119
Hash table size 2048 #key 3: resizing
Hash table size 2048 #key 5: resizing
box[0]  19.700 0.000 0.000
box[0]  19.700 0.000 0.000
Hash table size 2048 #key 14: resizing
Hash table size 2048 #key 2: resizing
box[0]  19.700 0.000 0.000
box[0]  19.700 0.000 0.000
Hash table mod 8 nalloc 109
box[0]  19.700 0.000 0.000
box[0]  19.700 0.000 0.000
box[0]  19.700 0.000 0.000
box[0]  19.700 0.000 0.000
Hash table mod 32 nalloc 138
Hash table size 2048 #key 22: resizing
Hash table size 2048 #key 17: resizing
box[0]  19.700 0.000 0.000
Hash table size 2048 #key 3: resizing
Hash table mod 32 nalloc 138
Hash table size 2048 #key 3: resizing
Hash table size 2048 #key 9: resizing
box[0]  19.700 0.000 0.000
Hash table size 2048 #key 9: resizing
Hash table size 2048 #key 7: resizing
  v[1]  0.000 1.000 0.000
box[0]  19.700 0.000 0.000
Hash table size 2048 #key 1: resizing
Hash table size 2048 #key 12: resizing
box[0]  19.700 0.000 0.000
  v[1]  0.000 1.000 0.000
Hash table mod 16 nalloc 119
box[0]  19.700 0.000 0.000
Hash table mod 8 nalloc 109
Hash table mod 16 nalloc 119
  v[1]  0.000 1.000 0.000
  v[1]  0.000 1.000 0.000
Hash table mod 32 nalloc 138
Hash table mod 4 nalloc 104
  v[1]  0.000 1.000 0.000
  v[1]  0.000 1.000 0.000
box[0]  19.700 0.000 0.000
  v[1]  0.000 1.000 0.000
  v[1]  0.000 1.000 0.000
  v[1]  0.000 1.000 0.000
  v[1]  0.000 1.000 0.000
box[0]  19.700 0.000 0.000
Hash table mod 64 nalloc 176
Hash table mod 64 nalloc 176
  v[1]  0.000 1.000 0.000
Hash table mod 8 nalloc 109
box[0]  19.700 0.000 0.000
Hash table mod 8 nalloc 109
Hash table mod 32 nalloc 138
  v[1]  0.000 1.000 0.000
Hash table mod 32 nalloc 138
Hash table mod 16 nalloc 119
  v[2]  0.707 0.000 1.000
  v[1]  0.000 1.000 0.000
Hash table mod 4 nalloc 104
Hash table mod 32 nalloc 138
  v[1]  0.000 1.000 0.000
  v[2]  0.707 0.000 1.000
box[0]  19.700 0.000 0.000
  v[1]  0.000 1.000 0.000
box[0]  19.700 0.000 0.000
box[0]  19.700 0.000 0.000
  v[2]  0.707 0.000 1.000
  v[2]  0.707 0.000 1.000
box[0]  19.700 0.000 0.000
box[0]  19.700 0.000 0.000
  v[2]  0.707 0.000 1.000
  v[2]  0.707 0.000 1.000
  v[1]  0.000 1.000 0.000
  v[2]  0.707 0.000 1.000
  v[2]  0.707 0.000 1.000
  v[2]  0.707 0.000 1.000
  v[2]  0.707 0.000 1.000
  v[1]  0.000 1.000 0.000
box[0]  19.700 0.000 0.000
box[0]  19.700 0.000 0.000
  v[2]  0.707 0.000 1.000
box[0]  19.700 0.000 0.000
  v[1]  0.000 1.000 0.000
box[0]  19.700 0.000 0.000
box[0]  19.700 0.000 0.000
  v[2]  0.707 0.000 1.000
box[0]  19.700 0.000 0.000
box[0]  19.700 0.000 0.000
skew_fac[0] = 0.816496
  v[2]  0.707 0.000 1.000
box[0]  19.700 0.000 0.000
box[0]  19.700 0.000 0.000
  v[2]  0.707 0.000 1.000
skew_fac[0] = 0.816496
  v[1]  0.000 1.000 0.000
  v[2]  0.707 0.000 1.000
  v[1]  0.000 1.000 0.000
  v[1]  0.000 1.000 0.000
skew_fac[0] = 0.816496
skew_fac[0] = 0.816496
  v[1]  0.000 1.000 0.000
  v[1]  0.000 1.000 0.000
skew_fac[0] = 0.816496
skew_fac[0] = 0.816496
  v[2]  0.707 0.000 1.000
skew_fac[0] = 0.816496
skew_fac[0] = 0.816496
skew_fac[0] = 0.816496
skew_fac[0] = 0.816496
  v[2]  0.707 0.000 1.000
  v[1]  0.000 1.000 0.000
  v[1]  0.000 1.000 0.000
skew_fac[0] = 0.816496
  v[1]  0.000 1.000 0.000
  v[2]  0.707 0.000 1.000
  v[1]  0.000 1.000 0.000
  v[1]  0.000 1.000 0.000
skew_fac[0] = 0.816496
  v[1]  0.000 1.000 0.000
  v[1]  0.000 1.000 0.000
normal[0]  0.667 0.000 -0.471
skew_fac[0] = 0.816496
  v[1]  0.000 1.000 0.000
  v[1]  0.000 1.000 0.000
skew_fac[0] = 0.816496
normal[0]  0.667 0.000 -0.471
  v[2]  0.707 0.000 1.000
skew_fac[0] = 0.816496
  v[2]  0.707 0.000 1.000
  v[2]  0.707 0.000 1.000
normal[0]  0.667 0.000 -0.471
normal[0]  0.667 0.000 -0.471
  v[2]  0.707 0.000 1.000
  v[2]  0.707 0.000 1.000
normal[0]  0.667 0.000 -0.471
normal[0]  0.667 0.000 -0.471
skew_fac[0] = 0.816496
normal[0]  0.667 0.000 -0.471
normal[0]  0.667 0.000 -0.471
normal[0]  0.667 0.000 -0.471
normal[0]  0.667 0.000 -0.471
skew_fac[0] = 0.816496
  v[2]  0.707 0.000 1.000
  v[2]  0.707 0.000 1.000
normal[0]  0.667 0.000 -0.471
  v[2]  0.707 0.000 1.000
skew_fac[0] = 0.816496
  v[2]  0.707 0.000 1.000
  v[2]  0.707 0.000 1.000
normal[0]  0.667 0.000 -0.471
  v[2]  0.707 0.000 1.000
  v[2]  0.707 0.000 1.000
box[1]  0.000 19.700 0.000
normal[0]  0.667 0.000 -0.471
  v[2]  0.707 0.000 1.000
  v[2]  0.707 0.000 1.000
normal[0]  0.667 0.000 -0.471
box[1]  0.000 19.700 0.000
skew_fac[0] = 0.816496
normal[0]  0.667 0.000 -0.471
skew_fac[0] = 0.816496
skew_fac[0] = 0.816496
box[1]  0.000 19.700 0.000
box[1]  0.000 19.700 0.000
skew_fac[0] = 0.816496
skew_fac[0] = 0.816496
box[1]  0.000 19.700 0.000
box[1]  0.000 19.700 0.000
normal[0]  0.667 0.000 -0.471
box[1]  0.000 19.700 0.000
box[1]  0.000 19.700 0.000
box[1]  0.000 19.700 0.000
box[1]  0.000 19.700 0.000
normal[0]  0.667 0.000 -0.471
skew_fac[0] = 0.816496
skew_fac[0] = 0.816496
box[1]  0.000 19.700 0.000
skew_fac[0] = 0.816496
normal[0]  0.667 0.000 -0.471
skew_fac[0] = 0.816496
skew_fac[0] = 0.816496
box[1]  0.000 19.700 0.000
skew_fac[0] = 0.816496
skew_fac[0] = 0.816496
  v[2]  0.000 0.707 1.000
box[1]  0.000 19.700 0.000
skew_fac[0] = 0.816496
skew_fac[0] = 0.816496
box[1]  0.000 19.700 0.000
  v[2]  0.000 0.707 1.000
normal[0]  0.667 0.000 -0.471
box[1]  0.000 19.700 0.000
normal[0]  0.667 0.000 -0.471
normal[0]  0.667 0.000 -0.471
  v[2]  0.000 0.707 1.000
  v[2]  0.000 0.707 1.000
normal[0]  0.667 0.000 -0.471
normal[0]  0.667 0.000 -0.471
  v[2]  0.000 0.707 1.000
  v[2]  0.000 0.707 1.000
box[1]  0.000 19.700 0.000
  v[2]  0.000 0.707 1.000
  v[2]  0.000 0.707 1.000
  v[2]  0.000 0.707 1.000
  v[2]  0.000 0.707 1.000
box[1]  0.000 19.700 0.000
normal[0]  0.667 0.000 -0.471
normal[0]  0.667 0.000 -0.471
  v[2]  0.000 0.707 1.000
normal[0]  0.667 0.000 -0.471
box[1]  0.000 19.700 0.000
normal[0]  0.667 0.000 -0.471
normal[0]  0.667 0.000 -0.471
  v[2]  0.000 0.707 1.000
normal[0]  0.667 0.000 -0.471
normal[0]  0.667 0.000 -0.471
skew_fac[1] = 0.816496
  v[2]  0.000 0.707 1.000
normal[0]  0.667 0.000 -0.471
normal[0]  0.667 0.000 -0.471
  v[2]  0.000 0.707 1.000
skew_fac[1] = 0.816496
box[1]  0.000 19.700 0.000
  v[2]  0.000 0.707 1.000
box[1]  0.000 19.700 0.000
box[1]  0.000 19.700 0.000
skew_fac[1] = 0.816496
skew_fac[1] = 0.816496
box[1]  0.000 19.700 0.000
box[1]  0.000 19.700 0.000
skew_fac[1] = 0.816496
skew_fac[1] = 0.816496
  v[2]  0.000 0.707 1.000
skew_fac[1] = 0.816496
skew_fac[1] = 0.816496
skew_fac[1] = 0.816496
skew_fac[1] = 0.816496
  v[2]  0.000 0.707 1.000
box[1]  0.000 19.700 0.000
box[1]  0.000 19.700 0.000
skew_fac[1] = 0.816496
box[1]  0.000 19.700 0.000
  v[2]  0.000 0.707 1.000
box[1]  0.000 19.700 0.000
box[1]  0.000 19.700 0.000
skew_fac[1] = 0.816496
box[1]  0.000 19.700 0.000
box[1]  0.000 19.700 0.000
normal[1]  0.000 0.667 -0.471
skew_fac[1] = 0.816496
box[1]  0.000 19.700 0.000
box[1]  0.000 19.700 0.000
skew_fac[1] = 0.816496
normal[1]  0.000 0.667 -0.471
  v[2]  0.000 0.707 1.000
skew_fac[1] = 0.816496
  v[2]  0.000 0.707 1.000
  v[2]  0.000 0.707 1.000
normal[1]  0.000 0.667 -0.471
normal[1]  0.000 0.667 -0.471
  v[2]  0.000 0.707 1.000
  v[2]  0.000 0.707 1.000
normal[1]  0.000 0.667 -0.471
normal[1]  0.000 0.667 -0.471
skew_fac[1] = 0.816496
normal[1]  0.000 0.667 -0.471
normal[1]  0.000 0.667 -0.471
normal[1]  0.000 0.667 -0.471
normal[1]  0.000 0.667 -0.471
skew_fac[1] = 0.816496
  v[2]  0.000 0.707 1.000
  v[2]  0.000 0.707 1.000
normal[1]  0.000 0.667 -0.471
  v[2]  0.000 0.707 1.000
skew_fac[1] = 0.816496
  v[2]  0.000 0.707 1.000
  v[2]  0.000 0.707 1.000
normal[1]  0.000 0.667 -0.471
  v[2]  0.000 0.707 1.000
  v[2]  0.000 0.707 1.000
cell_x[0] 14.775127 - 19.700171 skew_fac 0.816496
normal[1]  0.000 0.667 -0.471
  v[2]  0.000 0.707 1.000
  v[2]  0.000 0.707 1.000
normal[1]  0.000 0.667 -0.471
cell_x[0] 14.775127 - 19.700171 skew_fac 0.816496
skew_fac[1] = 0.816496
normal[1]  0.000 0.667 -0.471
skew_fac[1] = 0.816496
skew_fac[1] = 0.816496
cell_x[0] 0.000000 - 4.925043 skew_fac 0.816496
cell_x[0] 4.925043 - 9.850085 skew_fac 0.816496
skew_fac[1] = 0.816496
skew_fac[1] = 0.816496
cell_x[0] 14.775127 - 19.700171 skew_fac 0.816496
cell_x[0] 0.000000 - 4.925043 skew_fac 0.816496
normal[1]  0.000 0.667 -0.471
cell_x[0] 0.000000 - 4.925043 skew_fac 0.816496
cell_x[0] 14.775127 - 19.700171 skew_fac 0.816496
cell_x[0] 0.000000 - 4.925043 skew_fac 0.816496
cell_x[0] 9.850085 - 14.775127 skew_fac 0.816496
normal[1]  0.000 0.667 -0.471
skew_fac[1] = 0.816496
skew_fac[1] = 0.816496
cell_x[0] 14.775127 - 19.700171 skew_fac 0.816496
skew_fac[1] = 0.816496
normal[1]  0.000 0.667 -0.471
skew_fac[1] = 0.816496
skew_fac[1] = 0.816496
cell_x[0] 0.000000 - 4.925043 skew_fac 0.816496
skew_fac[1] = 0.816496
skew_fac[1] = 0.816496
cell_x[1] 4.925043 - 9.850085 skew_fac 0.816496
cell_x[0] 0.000000 - 4.925043 skew_fac 0.816496
skew_fac[1] = 0.816496
skew_fac[1] = 0.816496
cell_x[0] 9.850085 - 14.775127 skew_fac 0.816496
cell_x[1] 0.000000 - 4.925043 skew_fac 0.816496
normal[1]  0.000 0.667 -0.471
cell_x[0] 14.775127 - 19.700171 skew_fac 0.816496
normal[1]  0.000 0.667 -0.471
normal[1]  0.000 0.667 -0.471
cell_x[1] 9.850085 - 14.775127 skew_fac 0.816496
cell_x[1] 0.000000 - 4.925043 skew_fac 0.816496
normal[1]  0.000 0.667 -0.471
normal[1]  0.000 0.667 -0.471
cell_x[1] 9.850085 - 14.775127 skew_fac 0.816496
cell_x[1] 4.925043 - 9.850085 skew_fac 0.816496
cell_x[0] 14.775127 - 19.700171 skew_fac 0.816496
cell_x[1] 14.775127 - 19.700171 skew_fac 0.816496
cell_x[1] 14.775127 - 19.700171 skew_fac 0.816496
cell_x[1] 0.000000 - 4.925043 skew_fac 0.816496
cell_x[1] 14.775127 - 19.700171 skew_fac 0.816496
cell_x[0] 4.925043 - 9.850085 skew_fac 0.816496
normal[1]  0.000 0.667 -0.471
normal[1]  0.000 0.667 -0.471
cell_x[1] 0.000000 - 4.925043 skew_fac 0.816496
normal[1]  0.000 0.667 -0.471
cell_x[0] 4.925043 - 9.850085 skew_fac 0.816496
normal[1]  0.000 0.667 -0.471
normal[1]  0.000 0.667 -0.471
cell_x[1] 14.775127 - 19.700171 skew_fac 0.816496
normal[1]  0.000 0.667 -0.471
normal[1]  0.000 0.667 -0.471
cell_x[2] 6.965060 - 13.930120 skew_fac 1.000000
cell_x[1] 9.850085 - 14.775127 skew_fac 0.816496
normal[1]  0.000 0.667 -0.471
normal[1]  0.000 0.667 -0.471
cell_x[1] 9.850085 - 14.775127 skew_fac 0.816496
cell_x[2] 6.965060 - 13.930120 skew_fac 1.000000
cell_x[0] 14.775127 - 19.700171 skew_fac 0.816496
cell_x[1] 14.775127 - 19.700171 skew_fac 0.816496
cell_x[0] 0.000000 - 4.925043 skew_fac 0.816496
cell_x[0] 9.850085 - 14.775127 skew_fac 0.816496
cell_x[2] 6.965060 - 13.930120 skew_fac 1.000000
cell_x[2] 0.000000 - 6.965060 skew_fac 1.000000
cell_x[0] 9.850085 - 14.775127 skew_fac 0.816496
cell_x[0] 9.850085 - 14.775127 skew_fac 0.816496
cell_x[2] 6.965060 - 13.930120 skew_fac 1.000000
cell_x[2] 0.000000 - 6.965060 skew_fac 1.000000
cell_x[1] 9.850085 - 14.775127 skew_fac 0.816496
cell_x[2] 6.965060 - 13.930120 skew_fac 1.000000
cell_x[2] 6.965060 - 13.930120 skew_fac 1.000000
cell_x[2] 0.000000 - 6.965060 skew_fac 1.000000
cell_x[2] 6.965060 - 13.930120 skew_fac 1.000000
cell_x[1] 0.000000 - 4.925043 skew_fac 0.816496
cell_x[0] 4.925043 - 9.850085 skew_fac 0.816496
cell_x[0] 9.850085 - 14.775127 skew_fac 0.816496
cell_x[2] 0.000000 - 6.965060 skew_fac 1.000000
cell_x[0] 4.925043 - 9.850085 skew_fac 0.816496
cell_x[1] 9.850085 - 14.775127 skew_fac 0.816496
cell_x[0] 4.925043 - 9.850085 skew_fac 0.816496
cell_x[0] 9.850085 - 14.775127 skew_fac 0.816496
cell_x[2] 0.000000 - 6.965060 skew_fac 1.000000
cell_x[0] 4.925043 - 9.850085 skew_fac 0.816496
cell_x[0] 0.000000 - 4.925043 skew_fac 0.816496
cell_x[2] 0.000000 - 6.965060 skew_fac 1.000000
cell_x[0] 4.925043 - 9.850085 skew_fac 0.816496
Sending ddim 0 dir 0: ncg 0 nat 0
cell_x[0] 9.850085 - 14.775127 skew_fac 0.816496
cell_x[2] 6.965060 - 13.930120 skew_fac 1.000000
cell_x[1] 4.925043 - 9.850085 skew_fac 0.816496
Sending ddim 0 dir 0: ncg 0 nat 0
cell_x[2] 0.000000 - 6.965060 skew_fac 1.000000
cell_x[1] 4.925043 - 9.850085 skew_fac 0.816496
cell_x[1] 0.000000 - 4.925043 skew_fac 0.816496
Sending ddim 0 dir 0: ncg 0 nat 0
cell_x[1] 4.925043 - 9.850085 skew_fac 0.816496
Sending ddim 0 dir 0: ncg 0 nat 0
cell_x[1] 0.000000 - 4.925043 skew_fac 0.816496
Sending ddim 0 dir 0: ncg 0 nat 0
cell_x[2] 0.000000 - 6.965060 skew_fac 1.000000
Sending ddim 0 dir 0: ncg 0 nat 0
Sending ddim 0 dir 0: ncg 0 nat 0
Sending ddim 0 dir 0: ncg 0 nat 0
Sending ddim 0 dir 0: ncg 0 nat 0
cell_x[2] 6.965060 - 13.930120 skew_fac 1.000000
Sending ddim 0 dir 0: ncg 0 nat 0
cell_x[1] 4.925043 - 9.850085 skew_fac 0.816496
cell_x[1] 9.850085 - 14.775127 skew_fac 0.816496
cell_x[1] 14.775127 - 19.700171 skew_fac 0.816496
Sending ddim 0 dir 0: ncg 0 nat 0
cell_x[2] 0.000000 - 6.965060 skew_fac 1.000000
cell_x[1] 4.925043 - 9.850085 skew_fac 0.816496
cell_x[1] 14.775127 - 19.700171 skew_fac 0.816496
cell_x[1] 9.850085 - 14.775127 skew_fac 0.816496
Sending ddim 0 dir 0: ncg 0 nat 0
cell_x[1] 0.000000 - 4.925043 skew_fac 0.816496
cell_x[1] 14.775127 - 19.700171 skew_fac 0.816496
Sending ddim 0 dir 0: ncg 0 nat 0
cell_x[1] 4.925043 - 9.850085 skew_fac 0.816496
cell_x[2] 0.000000 - 6.965060 skew_fac 1.000000
Sending ddim 0 dir 0: ncg 0 nat 0
cell_x[2] 6.965060 - 13.930120 skew_fac 1.000000
Sending ddim 0 dir 0: ncg 0 nat 0
cell_x[2] 6.965060 - 13.930120 skew_fac 1.000000
cell_x[2] 0.000000 - 6.965060 skew_fac 1.000000
cell_x[2] 0.000000 - 6.965060 skew_fac 1.000000
Sending ddim 0 dir 0: ncg 0 nat 0
Sending ddim 0 dir 1: ncg 0 nat 0
cell_x[2] 6.965060 - 13.930120 skew_fac 1.000000
Sending ddim 0 dir 0: ncg 0 nat 0
cell_x[2] 0.000000 - 6.965060 skew_fac 1.000000
cell_x[2] 0.000000 - 6.965060 skew_fac 1.000000
Sending ddim 0 dir 1: ncg 0 nat 0
cell_x[2] 0.000000 - 6.965060 skew_fac 1.000000
Sending ddim 0 dir 0: ncg 0 nat 0
cell_x[2] 0.000000 - 6.965060 skew_fac 1.000000
cell_x[2] 6.965060 - 13.930120 skew_fac 1.000000
cell_x[2] 6.965060 - 13.930120 skew_fac 1.000000
cell_x[2] 6.965060 - 13.930120 skew_fac 1.000000
cell_x[2] 6.965060 - 13.930120 skew_fac 1.000000
Sending ddim 0 dir 1: ncg 0 nat 0
Sending ddim 0 dir 0: ncg 0 nat 0
Sending ddim 0 dir 0: ncg 0 nat 0
Sending ddim 0 dir 0: ncg 0 nat 0
Sending ddim 0 dir 0: ncg 0 nat 0
Sending ddim 0 dir 0: ncg 0 nat 0
Sending ddim 0 dir 0: ncg 0 nat 0
Sending ddim 0 dir 0: ncg 0 nat 0
Sending ddim 0 dir 0: ncg 0 nat 0
Sending ddim 0 dir 1: ncg 0 nat 0
Sending ddim 0 dir 0: ncg 0 nat 0
Sending ddim 0 dir 0: ncg 0 nat 0
Sending ddim 0 dir 0: ncg 0 nat 0
Sending ddim 0 dir 0: ncg 0 nat 0
Sending ddim 0 dir 0: ncg 0 nat 0
Sending ddim 0 dir 0: ncg 0 nat 0
Sending ddim 0 dir 1: ncg 0 nat 0
Sending ddim 0 dir 1: ncg 0 nat 0
Sending ddim 0 dir 1: ncg 0 nat 0
Sending ddim 0 dir 1: ncg 0 nat 0
Sending ddim 0 dir 1: ncg 0 nat 0
Sending ddim 0 dir 1: ncg 0 nat 0
Sending ddim 0 dir 1: ncg 0 nat 0
Sending ddim 0 dir 1: ncg 0 nat 0
Sending ddim 0 dir 1: ncg 0 nat 0
Sending ddim 0 dir 1: ncg 0 nat 0
Sending ddim 0 dir 1: ncg 0 nat 0
Sending ddim 0 dir 1: ncg 0 nat 0
Sending ddim 0 dir 1: ncg 0 nat 0
Sending ddim 0 dir 1: ncg 0 nat 0
Sending ddim 0 dir 1: ncg 0 nat 0
Sending ddim 0 dir 1: ncg 0 nat 0
Sending ddim 0 dir 1: ncg 0 nat 0
Sending ddim 0 dir 1: ncg 0 nat 0
Sending ddim 0 dir 1: ncg 0 nat 0
Sending ddim 0 dir 1: ncg 0 nat 0
Sending ddim 0 dir 1: ncg 0 nat 0
Sending ddim 0 dir 1: ncg 0 nat 0
Sending ddim 0 dir 1: ncg 0 nat 0
Sending ddim 0 dir 1: ncg 0 nat 0
Sending ddim 0 dir 1: ncg 0 nat 0
Sending ddim 0 dir 1: ncg 0 nat 0
Sending ddim 0 dir 1: ncg 0 nat 0
Sending ddim 0 dir 1: ncg 0 nat 0
Sending ddim 1 dir 0: ncg 0 nat 0
Sending ddim 1 dir 0: ncg 0 nat 0
Sending ddim 1 dir 0: ncg 0 nat 0
Sending ddim 1 dir 0: ncg 0 nat 0
Sending ddim 1 dir 0: ncg 0 nat 0
Sending ddim 1 dir 0: ncg 0 nat 0
Sending ddim 1 dir 0: ncg 0 nat 0
Sending ddim 1 dir 0: ncg 0 nat 0
Sending ddim 1 dir 0: ncg 0 nat 0
Sending ddim 1 dir 0: ncg 0 nat 0
Sending ddim 1 dir 0: ncg 0 nat 0
Sending ddim 1 dir 0: ncg 0 nat 0
Sending ddim 1 dir 0: ncg 0 nat 0
Sending ddim 1 dir 0: ncg 0 nat 0
Sending ddim 1 dir 0: ncg 0 nat 0
Sending ddim 1 dir 0: ncg 0 nat 0
Sending ddim 1 dir 0: ncg 0 nat 0
Sending ddim 1 dir 0: ncg 0 nat 0
Sending ddim 1 dir 0: ncg 0 nat 0
Sending ddim 1 dir 0: ncg 0 nat 0
Sending ddim 1 dir 0: ncg 0 nat 0
Sending ddim 1 dir 0: ncg 0 nat 0
Sending ddim 1 dir 0: ncg 0 nat 0
Sending ddim 1 dir 0: ncg 0 nat 0
Sending ddim 1 dir 0: ncg 0 nat 0
Sending ddim 1 dir 0: ncg 0 nat 0
Sending ddim 1 dir 0: ncg 0 nat 0
Sending ddim 1 dir 0: ncg 0 nat 0
Sending ddim 1 dir 0: ncg 0 nat 0
Sending ddim 1 dir 0: ncg 0 nat 0
Sending ddim 1 dir 0: ncg 0 nat 0
Sending ddim 1 dir 0: ncg 0 nat 0
Sending ddim 1 dir 1: ncg 0 nat 0
Sending ddim 1 dir 1: ncg 0 nat 0
Sending ddim 1 dir 1: ncg 0 nat 0
Sending ddim 1 dir 1: ncg 0 nat 0
Sending ddim 1 dir 1: ncg 0 nat 0
Sending ddim 1 dir 1: ncg 0 nat 0
Sending ddim 1 dir 1: ncg 0 nat 0
Sending ddim 1 dir 1: ncg 0 nat 0
Sending ddim 1 dir 1: ncg 0 nat 0
Sending ddim 1 dir 1: ncg 0 nat 0
Sending ddim 1 dir 1: ncg 0 nat 0
Sending ddim 1 dir 1: ncg 0 nat 0
Sending ddim 1 dir 1: ncg 0 nat 0
Sending ddim 1 dir 1: ncg 0 nat 0
Sending ddim 1 dir 1: ncg 0 nat 0
Sending ddim 1 dir 1: ncg 0 nat 0
Sending ddim 1 dir 1: ncg 0 nat 0
Sending ddim 1 dir 1: ncg 0 nat 0
Sending ddim 1 dir 1: ncg 0 nat 0
Sending ddim 1 dir 1: ncg 0 nat 0
Sending ddim 1 dir 1: ncg 0 nat 0
Sending ddim 1 dir 1: ncg 0 nat 0
Sending ddim 1 dir 1: ncg 0 nat 0
Sending ddim 1 dir 1: ncg 0 nat 0
Sending ddim 1 dir 1: ncg 0 nat 0
Sending ddim 1 dir 1: ncg 0 nat 0
Sending ddim 1 dir 1: ncg 0 nat 0
Sending ddim 1 dir 1: ncg 0 nat 0
Sending ddim 1 dir 1: ncg 0 nat 0
Sending ddim 1 dir 1: ncg 0 nat 0
Sending ddim 1 dir 1: ncg 0 nat 0
Sending ddim 1 dir 1: ncg 0 nat 0
Sending ddim 2 dir 0: ncg 0 nat 0
Sending ddim 2 dir 0: ncg 0 nat 0
Sending ddim 2 dir 0: ncg 0 nat 0
Sending ddim 2 dir 0: ncg 0 nat 0
Sending ddim 2 dir 0: ncg 0 nat 0
Sending ddim 2 dir 0: ncg 0 nat 0
Sending ddim 2 dir 0: ncg 0 nat 0
Sending ddim 2 dir 0: ncg 0 nat 0
Sending ddim 2 dir 0: ncg 0 nat 0
Sending ddim 2 dir 0: ncg 0 nat 0
Sending ddim 2 dir 0: ncg 0 nat 0
Sending ddim 2 dir 0: ncg 0 nat 0
Sending ddim 2 dir 0: ncg 0 nat 0
Sending ddim 2 dir 0: ncg 0 nat 0
Sending ddim 2 dir 0: ncg 0 nat 0
Sending ddim 2 dir 0: ncg 0 nat 0
Sending ddim 2 dir 0: ncg 0 nat 0
Sending ddim 2 dir 0: ncg 0 nat 0
Sending ddim 2 dir 0: ncg 0 nat 0
Sending ddim 2 dir 0: ncg 0 nat 0
Sending ddim 2 dir 0: ncg 0 nat 0
Sending ddim 2 dir 0: ncg 0 nat 0
Sending ddim 2 dir 0: ncg 0 nat 0
Sending ddim 2 dir 0: ncg 0 nat 0
Sending ddim 2 dir 0: ncg 0 nat 0
Sending ddim 2 dir 0: ncg 0 nat 0
Sending ddim 2 dir 0: ncg 0 nat 0
Sending ddim 2 dir 0: ncg 0 nat 0
Sending ddim 2 dir 0: ncg 0 nat 0
Sending ddim 2 dir 0: ncg 0 nat 0
Sending ddim 2 dir 0: ncg 0 nat 0
Sending ddim 2 dir 0: ncg 0 nat 0
Finished repartitioning: cgs moved out 0, new home 1523
Finished repartitioning: cgs moved out 0, new home 1455
Finished repartitioning: cgs moved out 0, new home 1442
Finished repartitioning: cgs moved out 0, new home 1469
Finished repartitioning: cgs moved out 0, new home 1461
Finished repartitioning: cgs moved out 0, new home 1493
Finished repartitioning: cgs moved out 0, new home 1455
Finished repartitioning: cgs moved out 0, new home 1447
Finished repartitioning: cgs moved out 0, new home 1461
Finished repartitioning: cgs moved out 0, new home 1465
Finished repartitioning: cgs moved out 0, new home 1463
Finished repartitioning: cgs moved out 0, new home 1462
Finished repartitioning: cgs moved out 0, new home 1445
Finished repartitioning: cgs moved out 0, new home 1463
Finished repartitioning: cgs moved out 0, new home 1466
Finished repartitioning: cgs moved out 0, new home 1451
Finished repartitioning: cgs moved out 0, new home 1489
Finished repartitioning: cgs moved out 0, new home 1695
Finished repartitioning: cgs moved out 0, new home 1561
Finished repartitioning: cgs moved out 0, new home 1591
Finished repartitioning: cgs moved out 0, new home 1474
Finished repartitioning: cgs moved out 0, new home 1475
Finished repartitioning: cgs moved out 0, new home 1471
Finished repartitioning: cgs moved out 0, new home 1604
Finished repartitioning: cgs moved out 0, new home 1580
Finished repartitioning: cgs moved out 0, new home 1502
Finished repartitioning: cgs moved out 0, new home 1428
Finished repartitioning: cgs moved out 0, new home 1741
Finished repartitioning: cgs moved out 0, new home 1551
Finished repartitioning: cgs moved out 0, new home 1455
Finished repartitioning: cgs moved out 0, new home 1479
Finished repartitioning: cgs moved out 0, new home 1479
Set grid boundaries dim 0: 14.775127 19.700171
Set grid boundaries dim 0: 14.775127 19.700171
Set grid boundaries dim 0: 14.775127 19.700171
Set grid boundaries dim 0: 14.775127 19.700171
Set grid boundaries dim 0: 14.775127 19.700171
Set grid boundaries dim 0: 14.775127 19.700171
Set grid boundaries dim 0: 14.775127 19.700171
Set grid boundaries dim 0: 14.775127 19.700171
Set grid boundaries dim 0: 0.000000 4.925043
Set grid boundaries dim 0: 0.000000 4.925043
Set grid boundaries dim 0: 0.000000 4.925043
Set grid boundaries dim 0: 0.000000 4.925043
Set grid boundaries dim 0: 0.000000 4.925043
Set grid boundaries dim 0: 0.000000 4.925043
Set grid boundaries dim 0: 0.000000 4.925043
Set grid boundaries dim 0: 0.000000 4.925043
Set grid boundaries dim 0: 9.850085 14.775127
Set grid boundaries dim 0: 9.850085 14.775127
Set grid boundaries dim 0: 9.850085 14.775127
Set grid boundaries dim 0: 9.850085 14.775127
Set grid boundaries dim 0: 9.850085 14.775127
Set grid boundaries dim 0: 9.850085 14.775127
Set grid boundaries dim 0: 9.850085 14.775127
Set grid boundaries dim 0: 9.850085 14.775127
Set grid boundaries dim 0: 4.925043 9.850085
Set grid boundaries dim 0: 4.925043 9.850085
Set grid boundaries dim 0: 4.925043 9.850085
Set grid boundaries dim 0: 4.925043 9.850085
Set grid boundaries dim 0: 4.925043 9.850085
Set grid boundaries dim 0: 4.925043 9.850085
Set grid boundaries dim 0: 4.925043 9.850085
Set grid boundaries dim 0: 4.925043 9.850085
Set grid boundaries dim 1: 9.850085 14.775127
Set grid boundaries dim 1: 9.850085 14.775127
Set grid boundaries dim 1: 0.000000 4.925043
Set grid boundaries dim 1: 0.000000 4.925043
Set grid boundaries dim 1: 14.775127 19.700171
Set grid boundaries dim 1: 14.775127 19.700171
Set grid boundaries dim 1: 4.925043 9.850085
Set grid boundaries dim 1: 4.925043 9.850085
Set grid boundaries dim 1: 14.775127 19.700171
Set grid boundaries dim 1: 14.775127 19.700171
Set grid boundaries dim 1: 0.000000 4.925043
Set grid boundaries dim 1: 0.000000 4.925043
Set grid boundaries dim 1: 9.850085 14.775127
Set grid boundaries dim 1: 9.850085 14.775127
Set grid boundaries dim 1: 4.925043 9.850085
Set grid boundaries dim 1: 4.925043 9.850085
Set grid boundaries dim 1: 9.850085 14.775127
Set grid boundaries dim 1: 9.850085 14.775127
Set grid boundaries dim 1: 4.925043 9.850085
Set grid boundaries dim 1: 4.925043 9.850085
Set grid boundaries dim 1: 0.000000 4.925043
Set grid boundaries dim 1: 0.000000 4.925043
Set grid boundaries dim 1: 14.775127 19.700171
Set grid boundaries dim 1: 14.775127 19.700171
Set grid boundaries dim 1: 9.850085 14.775127
Set grid boundaries dim 1: 9.850085 14.775127
Set grid boundaries dim 1: 4.925043 9.850085
Set grid boundaries dim 1: 4.925043 9.850085
Set grid boundaries dim 1: 0.000000 4.925043
Set grid boundaries dim 1: 0.000000 4.925043
Set grid boundaries dim 1: 14.775127 19.700171
Set grid boundaries dim 1: 14.775127 19.700171
Set grid boundaries dim 2: 0.000000 6.965060
Set grid boundaries dim 2: 6.965060 13.930120
Set grid boundaries dim 2: 6.965060 13.930120
Set grid boundaries dim 2: 0.000000 6.965060
Set grid boundaries dim 2: 6.965060 13.930120
Set grid boundaries dim 2: 0.000000 6.965060
Set grid boundaries dim 2: 6.965060 13.930120
Set grid boundaries dim 2: 0.000000 6.965060
Set grid boundaries dim 2: 6.965060 13.930120
Set grid boundaries dim 2: 0.000000 6.965060
Set grid boundaries dim 2: 0.000000 6.965060
Set grid boundaries dim 2: 6.965060 13.930120
Set grid boundaries dim 2: 6.965060 13.930120
Set grid boundaries dim 2: 0.000000 6.965060
Set grid boundaries dim 2: 6.965060 13.930120
Set grid boundaries dim 2: 0.000000 6.965060
Set grid boundaries dim 2: 6.965060 13.930120
Set grid boundaries dim 2: 0.000000 6.965060
Set grid boundaries dim 2: 6.965060 13.930120
Set grid boundaries dim 2: 0.000000 6.965060
Set grid boundaries dim 2: 6.965060 13.930120
Set grid boundaries dim 2: 0.000000 6.965060
Set grid boundaries dim 2: 6.965060 13.930120
Set grid boundaries dim 2: 0.000000 6.965060
Set grid boundaries dim 2: 6.965060 13.930120
Set grid boundaries dim 2: 0.000000 6.965060
Set grid boundaries dim 2: 0.000000 6.965060
Set grid boundaries dim 2: 6.965060 13.930120
Set grid boundaries dim 2: 6.965060 13.930120
Set grid boundaries dim 2: 0.000000 6.965060
Set grid boundaries dim 2: 0.000000 6.965060
Set grid boundaries dim 2: 6.965060 13.930120
set_grid_sizes, i-zone bounds for dim 0: 14.775 19.700
set_grid_sizes, i-zone bounds for dim 0: 14.775 19.700
set_grid_sizes, i-zone bounds for dim 0: 14.775 19.700
set_grid_sizes, i-zone bounds for dim 0: 14.775 19.700
set_grid_sizes, i-zone bounds for dim 0: 14.775 19.700
set_grid_sizes, i-zone bounds for dim 0: 14.775 19.700
set_grid_sizes, i-zone bounds for dim 0: 14.775 19.700
set_grid_sizes, i-zone bounds for dim 0: 14.775 19.700
set_grid_sizes, i-zone bounds for dim 0:  0.000  4.925
set_grid_sizes, i-zone bounds for dim 0:  0.000  4.925
set_grid_sizes, i-zone bounds for dim 0:  0.000  4.925
set_grid_sizes, i-zone bounds for dim 0:  0.000  4.925
set_grid_sizes, i-zone bounds for dim 0:  0.000  4.925
set_grid_sizes, i-zone bounds for dim 0:  0.000  4.925
set_grid_sizes, i-zone bounds for dim 0:  0.000  4.925
set_grid_sizes, i-zone bounds for dim 0:  0.000  4.925
set_grid_sizes, i-zone bounds for dim 0:  9.850 14.775
set_grid_sizes, i-zone bounds for dim 0:  9.850 14.775
set_grid_sizes, i-zone bounds for dim 0:  9.850 14.775
set_grid_sizes, i-zone bounds for dim 0:  9.850 14.775
set_grid_sizes, i-zone bounds for dim 0:  9.850 14.775
set_grid_sizes, i-zone bounds for dim 0:  9.850 14.775
set_grid_sizes, i-zone bounds for dim 0:  9.850 14.775
set_grid_sizes, i-zone bounds for dim 0:  9.850 14.775
set_grid_sizes, i-zone bounds for dim 0:  4.925  9.850
set_grid_sizes, i-zone bounds for dim 0:  4.925  9.850
set_grid_sizes, i-zone bounds for dim 0:  4.925  9.850
set_grid_sizes, i-zone bounds for dim 0:  4.925  9.850
set_grid_sizes, i-zone bounds for dim 0:  4.925  9.850
set_grid_sizes, i-zone bounds for dim 0:  4.925  9.850
set_grid_sizes, i-zone bounds for dim 0:  4.925  9.850
set_grid_sizes, i-zone bounds for dim 0:  4.925  9.850
set_grid_sizes, i-zone bounds for dim 1:  9.850 14.775
set_grid_sizes, i-zone bounds for dim 1:  9.850 14.775
set_grid_sizes, i-zone bounds for dim 1:  0.000  4.925
set_grid_sizes, i-zone bounds for dim 1:  0.000  4.925
set_grid_sizes, i-zone bounds for dim 1: 14.775 19.700
set_grid_sizes, i-zone bounds for dim 1: 14.775 19.700
set_grid_sizes, i-zone bounds for dim 1:  4.925  9.850
set_grid_sizes, i-zone bounds for dim 1:  4.925  9.850
set_grid_sizes, i-zone bounds for dim 1: 14.775 19.700
set_grid_sizes, i-zone bounds for dim 1: 14.775 19.700
set_grid_sizes, i-zone bounds for dim 1:  0.000  4.925
set_grid_sizes, i-zone bounds for dim 1:  0.000  4.925
set_grid_sizes, i-zone bounds for dim 1:  9.850 14.775
set_grid_sizes, i-zone bounds for dim 1:  9.850 14.775
set_grid_sizes, i-zone bounds for dim 1:  4.925  9.850
set_grid_sizes, i-zone bounds for dim 1:  4.925  9.850
set_grid_sizes, i-zone bounds for dim 1:  9.850 14.775
set_grid_sizes, i-zone bounds for dim 1:  9.850 14.775
set_grid_sizes, i-zone bounds for dim 1:  4.925  9.850
set_grid_sizes, i-zone bounds for dim 1:  4.925  9.850
set_grid_sizes, i-zone bounds for dim 1:  0.000  4.925
set_grid_sizes, i-zone bounds for dim 1:  0.000  4.925
set_grid_sizes, i-zone bounds for dim 1: 14.775 19.700
set_grid_sizes, i-zone bounds for dim 1: 14.775 19.700
set_grid_sizes, i-zone bounds for dim 1:  9.850 14.775
set_grid_sizes, i-zone bounds for dim 1:  9.850 14.775
set_grid_sizes, i-zone bounds for dim 1:  4.925  9.850
set_grid_sizes, i-zone bounds for dim 1:  4.925  9.850
set_grid_sizes, i-zone bounds for dim 1:  0.000  4.925
set_grid_sizes, i-zone bounds for dim 1:  0.000  4.925
set_grid_sizes, i-zone bounds for dim 1: 14.775 19.700
set_grid_sizes, i-zone bounds for dim 1: 14.775 19.700
set_grid_sizes, i-zone bounds for dim 2:  0.000  6.965
set_grid_sizes, i-zone bounds for dim 2:  6.965 13.930
set_grid_sizes, i-zone bounds for dim 2:  6.965 13.930
set_grid_sizes, i-zone bounds for dim 2:  0.000  6.965
set_grid_sizes, i-zone bounds for dim 2:  6.965 13.930
set_grid_sizes, i-zone bounds for dim 2:  0.000  6.965
set_grid_sizes, i-zone bounds for dim 2:  6.965 13.930
set_grid_sizes, i-zone bounds for dim 2:  0.000  6.965
set_grid_sizes, i-zone bounds for dim 2:  6.965 13.930
set_grid_sizes, i-zone bounds for dim 2:  0.000  6.965
set_grid_sizes, i-zone bounds for dim 2:  0.000  6.965
set_grid_sizes, i-zone bounds for dim 2:  6.965 13.930
set_grid_sizes, i-zone bounds for dim 2:  6.965 13.930
set_grid_sizes, i-zone bounds for dim 2:  0.000  6.965
set_grid_sizes, i-zone bounds for dim 2:  6.965 13.930
set_grid_sizes, i-zone bounds for dim 2:  0.000  6.965
set_grid_sizes, i-zone bounds for dim 2:  6.965 13.930
set_grid_sizes, i-zone bounds for dim 2:  0.000  6.965
set_grid_sizes, i-zone bounds for dim 2:  6.965 13.930
set_grid_sizes, i-zone bounds for dim 2:  0.000  6.965
set_grid_sizes, i-zone bounds for dim 2:  6.965 13.930
set_grid_sizes, i-zone bounds for dim 2:  0.000  6.965
set_grid_sizes, i-zone bounds for dim 2:  6.965 13.930
set_grid_sizes, i-zone bounds for dim 2:  0.000  6.965
set_grid_sizes, i-zone bounds for dim 2:  6.965 13.930
set_grid_sizes, i-zone bounds for dim 2:  0.000  6.965
set_grid_sizes, i-zone bounds for dim 2:  0.000  6.965
set_grid_sizes, i-zone bounds for dim 2:  6.965 13.930
set_grid_sizes, i-zone bounds for dim 2:  6.965 13.930
set_grid_sizes, i-zone bounds for dim 2:  0.000  6.965
set_grid_sizes, i-zone bounds for dim 2:  0.000  6.965
set_grid_sizes, i-zone bounds for dim 2:  6.965 13.930
CG density 9.014778 ideal ns cell size 1.035178
CG density 8.612280 ideal ns cell size 1.051059
CG density 8.535331 ideal ns cell size 1.054209
CG density 8.695147 ideal ns cell size 1.047710
CG density 8.647792 ideal ns cell size 1.049619
CG density 8.837203 ideal ns cell size 1.042066
CG density 8.612279 ideal ns cell size 1.051060
CG density 8.564926 ideal ns cell size 1.052993
CG density 8.647794 ideal ns cell size 1.049619
CG density 8.671470 ideal ns cell size 1.048663
CG density 8.659633 ideal ns cell size 1.049140
CG density 8.653713 ideal ns cell size 1.049379
CG density 8.553090 ideal ns cell size 1.053478
CG density 8.659634 ideal ns cell size 1.049140
CG density 8.677390 ideal ns cell size 1.048424
CG density 8.588604 ideal ns cell size 1.052024
CG density 8.813531 ideal ns cell size 1.042998
CG density 10.032864 ideal ns cell size 0.998907
CG density 9.239705 ideal ns cell size 1.026709
CG density 9.417277 ideal ns cell size 1.020215
CG density 8.724744 ideal ns cell size 1.046524
CG density 8.730662 ideal ns cell size 1.046287
CG density 8.706985 ideal ns cell size 1.047235
CG density 9.494225 ideal ns cell size 1.017451
CG density 9.352167 ideal ns cell size 1.022577
CG density 8.890478 ideal ns cell size 1.039980
CG density 8.452464 ideal ns cell size 1.057643
CG density 10.305140 ideal ns cell size 0.990031
CG density 9.180513 ideal ns cell size 1.028911
CG density 8.612280 ideal ns cell size 1.051059
CG density 8.754337 ideal ns cell size 1.045343
CG density 8.754337 ideal ns cell size 1.045343
grid dim 0 size 11 x 1.051339: 14.775127 - 26.339859
grid dim 0 size 11 x 1.051339: 19.700172 - 31.264904
grid dim 0 size 11 x 1.051339: 19.700172 - 31.264904
grid dim 0 size 11 x 1.051339: 14.775127 - 26.339859
grid dim 0 size 11 x 1.051339: 19.700172 - 31.264904
grid dim 0 size 11 x 1.051339: 14.775127 - 26.339859
grid dim 0 size 11 x 1.051339: 19.700172 - 31.264904
grid dim 0 size 11 x 1.051339: 14.775127 - 26.339859
grid dim 0 size 11 x 1.051339: 4.925045 - 16.489776
grid dim 0 size 11 x 1.051339: 0.000000 - 11.564731
grid dim 0 size 11 x 1.051339: 0.000000 - 11.564731
grid dim 0 size 11 x 1.051339: 4.925045 - 16.489776
grid dim 0 size 11 x 1.051339: 4.925045 - 16.489776
grid dim 0 size 11 x 1.051339: 0.000000 - 11.564731
grid dim 0 size 11 x 1.051339: 4.925045 - 16.489776
grid dim 0 size 11 x 1.051339: 0.000000 - 11.564731
grid dim 0 size 11 x 1.051339: 14.775130 - 26.339861
grid dim 0 size 12 x 0.963728: 9.850085 - 21.414816
grid dim 0 size 11 x 1.051339: 14.775130 - 26.339861
grid dim 0 size 11 x 1.051339: 9.850085 - 21.414816
grid dim 0 size 11 x 1.051339: 14.775130 - 26.339861
grid dim 0 size 11 x 1.051339: 9.850085 - 21.414816
grid dim 0 size 11 x 1.051339: 14.775130 - 26.339861
grid dim 0 size 11 x 1.051339: 9.850085 - 21.414816
grid dim 0 size 11 x 1.051339: 9.850088 - 21.414819
grid dim 0 size 11 x 1.051339: 4.925043 - 16.489774
grid dim 0 size 11 x 1.051339: 4.925043 - 16.489774
grid dim 0 size 12 x 0.963728: 9.850088 - 21.414819
grid dim 0 size 11 x 1.051339: 9.850088 - 21.414819
grid dim 0 size 11 x 1.051339: 4.925043 - 16.489774
grid dim 0 size 11 x 1.051339: 4.925043 - 16.489774
grid dim 0 size 11 x 1.051339: 9.850088 - 21.414819
grid dim 1 size 11 x 1.051339: 9.850085 - 21.414816
grid dim 1 size 11 x 1.051339: 14.775130 - 26.339861
grid dim 1 size 11 x 1.051339: 4.925045 - 16.489776
grid dim 1 size 11 x 1.051339: 0.000000 - 11.564731
grid dim 1 size 11 x 1.051339: 19.700172 - 31.264904
grid dim 1 size 11 x 1.051339: 14.775127 - 26.339859
grid dim 1 size 11 x 1.051339: 9.850088 - 21.414819
grid dim 1 size 11 x 1.051339: 4.925043 - 16.489774
grid dim 1 size 11 x 1.051339: 19.700172 - 31.264904
grid dim 1 size 11 x 1.051339: 14.775127 - 26.339859
grid dim 1 size 11 x 1.051339: 0.000000 - 11.564731
grid dim 1 size 11 x 1.051339: 4.925045 - 16.489776
grid dim 1 size 11 x 1.051339: 14.775130 - 26.339861
grid dim 1 size 11 x 1.051339: 9.850085 - 21.414816
grid dim 1 size 11 x 1.051339: 9.850088 - 21.414819
grid dim 1 size 11 x 1.051339: 4.925043 - 16.489774
grid dim 1 size 11 x 1.051339: 14.775130 - 26.339861
grid dim 1 size 12 x 0.963728: 9.850085 - 21.414816
grid dim 1 size 11 x 1.051339: 9.850088 - 21.414819
grid dim 1 size 11 x 1.051339: 4.925043 - 16.489774
grid dim 1 size 11 x 1.051339: 4.925045 - 16.489776
grid dim 1 size 11 x 1.051339: 0.000000 - 11.564731
grid dim 1 size 11 x 1.051339: 19.700172 - 31.264904
grid dim 1 size 11 x 1.051339: 14.775127 - 26.339859
grid dim 1 size 11 x 1.051339: 14.775130 - 26.339861
grid dim 1 size 11 x 1.051339: 9.850085 - 21.414816
grid dim 1 size 11 x 1.051339: 4.925043 - 16.489774
grid dim 1 size 12 x 0.963728: 9.850088 - 21.414819
grid dim 1 size 11 x 1.051339: 4.925045 - 16.489776
grid dim 1 size 11 x 1.051339: 0.000000 - 11.564731
grid dim 1 size 11 x 1.051339: 14.775127 - 26.339859
grid dim 1 size 11 x 1.051339: 19.700172 - 31.264904
grid dim 2 size 9 x 0.995009: 0.000000 - 8.955077
grid dim 2 size 9 x 0.995009: 6.965060 - 15.920138
grid dim 2 size 9 x 0.995009: 6.965060 - 15.920138
grid dim 2 size 9 x 0.995009: 0.000000 - 8.955077
grid dim 2 size 9 x 0.995009: 6.965060 - 15.920138
grid dim 2 size 9 x 0.995009: 0.000000 - 8.955077
grid dim 2 size 9 x 0.995009: 6.965060 - 15.920138
grid dim 2 size 9 x 0.995009: 0.000000 - 8.955077
grid dim 2 size 9 x 0.995009: 6.965060 - 15.920138
grid dim 2 size 9 x 0.995009: 0.000000 - 8.955077
grid dim 2 size 9 x 0.995009: 0.000000 - 8.955077
grid dim 2 size 9 x 0.995009: 6.965060 - 15.920138
grid dim 2 size 9 x 0.995009: 6.965060 - 15.920138
grid dim 2 size 9 x 0.995009: 0.000000 - 8.955077
grid dim 2 size 9 x 0.995009: 6.965060 - 15.920138
grid dim 2 size 9 x 0.995009: 0.000000 - 8.955077
grid dim 2 size 9 x 0.995009: 6.965060 - 15.920138
grid dim 2 size 9 x 0.995009: 0.000000 - 8.955077
grid dim 2 size 9 x 0.995009: 6.965060 - 15.920138
grid dim 2 size 9 x 0.995009: 0.000000 - 8.955077
grid dim 2 size 9 x 0.995009: 6.965060 - 15.920138
grid dim 2 size 9 x 0.995009: 0.000000 - 8.955077
grid dim 2 size 9 x 0.995009: 6.965060 - 15.920138
grid dim 2 size 9 x 0.995009: 0.000000 - 8.955077
grid dim 2 size 9 x 0.995009: 6.965060 - 15.920138
grid dim 2 size 9 x 0.995009: 0.000000 - 8.955077
grid dim 2 size 9 x 0.995009: 0.000000 - 8.955077
grid dim 2 size 9 x 0.995009: 6.965060 - 15.920138
grid dim 2 size 9 x 0.995009: 6.965060 - 15.920138
grid dim 2 size 9 x 0.995009: 0.000000 - 8.955077
grid dim 2 size 9 x 0.995009: 0.000000 - 8.955077
grid dim 2 size 9 x 0.995009: 6.965060 - 15.920138
CG ncg ideal 10, actual density 9.9
CG ncg ideal 10, actual density 9.5
CG ncg ideal 10, actual density 9.4
CG ncg ideal 10, actual density 9.6
CG ncg ideal 10, actual density 9.5
CG ncg ideal 10, actual density 9.7
CG ncg ideal 10, actual density 9.5
CG ncg ideal 10, actual density 9.4
CG ncg ideal 10, actual density 9.5
CG ncg ideal 10, actual density 9.5
CG ncg ideal 10, actual density 9.5
CG ncg ideal 10, actual density 9.5
CG ncg ideal 10, actual density 9.4
CG ncg ideal 10, actual density 9.5
CG ncg ideal 10, actual density 9.5
CG ncg ideal 10, actual density 9.4
CG ncg ideal 10, actual density 9.7
CG ncg ideal 10, actual density 9.3
CG ncg ideal 10, actual density 10.2
CG ncg ideal 10, actual density 10.4
CG ncg ideal 10, actual density 9.6
CG ncg ideal 10, actual density 9.6
CG ncg ideal 10, actual density 9.6
CG ncg ideal 10, actual density 10.4
CG ncg ideal 10, actual density 10.3
CG ncg ideal 10, actual density 9.8
CG ncg ideal 10, actual density 9.3
CG ncg ideal 10, actual density 9.5
CG ncg ideal 10, actual density 10.1
CG ncg ideal 10, actual density 9.5
CG ncg ideal 10, actual density 9.6
CG ncg ideal 10, actual density 9.6
Filling grid from 0 to 1523
Filling grid from 0 to 1455
Filling grid from 0 to 1442
Filling grid from 0 to 1469
Filling grid from 0 to 1461
Filling grid from 0 to 1493
Filling grid from 0 to 1455
Filling grid from 0 to 1447
Filling grid from 0 to 1461
Filling grid from 0 to 1465
Filling grid from 0 to 1463
Filling grid from 0 to 1462
Filling grid from 0 to 1445
Filling grid from 0 to 1463
Filling grid from 0 to 1466
Filling grid from 0 to 1451
Filling grid from 0 to 1489
Filling grid from 0 to 1695
Filling grid from 0 to 1561
Filling grid from 0 to 1591
Filling grid from 0 to 1474
Filling grid from 0 to 1475
Filling grid from 0 to 1471
Filling grid from 0 to 1604
Filling grid from 0 to 1580
Filling grid from 0 to 1502
Filling grid from 0 to 1428
Filling grid from 0 to 1741
Filling grid from 0 to 1551
Filling grid from 0 to 1455
Filling grid from 0 to 1479
Filling grid from 0 to 1479
Step 0, sorting the 1523 home charge groups
Step 0, sorting the 1455 home charge groups
Step 0, sorting the 1442 home charge groups
Step 0, sorting the 1469 home charge groups
Step 0, sorting the 1461 home charge groups
Step 0, sorting the 1493 home charge groups
Step 0, sorting the 1455 home charge groups
Step 0, sorting the 1447 home charge groups
Step 0, sorting the 1461 home charge groups
Step 0, sorting the 1465 home charge groups
Step 0, sorting the 1463 home charge groups
Step 0, sorting the 1462 home charge groups
Step 0, sorting the 1445 home charge groups
Step 0, sorting the 1463 home charge groups
Step 0, sorting the 1466 home charge groups
Step 0, sorting the 1451 home charge groups
Step 0, sorting the 1489 home charge groups
Step 0, sorting the 1695 home charge groups
Step 0, sorting the 1561 home charge groups
Step 0, sorting the 1591 home charge groups
Step 0, sorting the 1474 home charge groups
Step 0, sorting the 1475 home charge groups
Step 0, sorting the 1471 home charge groups
Step 0, sorting the 1604 home charge groups
Step 0, sorting the 1580 home charge groups
Step 0, sorting the 1502 home charge groups
Step 0, sorting the 1428 home charge groups
Step 0, sorting the 1741 home charge groups
Step 0, sorting the 1551 home charge groups
Step 0, sorting the 1455 home charge groups
Step 0, sorting the 1479 home charge groups
Step 0, sorting the 1479 home charge groups
ordered sort cgs: stationary 1523 moved 0
ordered sort cgs: stationary 1455 moved 0
ordered sort cgs: stationary 1442 moved 0
ordered sort cgs: stationary 1469 moved 0
ordered sort cgs: stationary 1461 moved 0
ordered sort cgs: stationary 1493 moved 0
ordered sort cgs: stationary 1455 moved 0
ordered sort cgs: stationary 1447 moved 0
ordered sort cgs: stationary 1461 moved 0
ordered sort cgs: stationary 1465 moved 0
ordered sort cgs: stationary 1463 moved 0
ordered sort cgs: stationary 1462 moved 0
ordered sort cgs: stationary 1445 moved 0
ordered sort cgs: stationary 1463 moved 0
ordered sort cgs: stationary 1466 moved 0
ordered sort cgs: stationary 1451 moved 0
ordered sort cgs: stationary 1489 moved 0
ordered sort cgs: stationary 1695 moved 0
ordered sort cgs: stationary 1561 moved 0
ordered sort cgs: stationary 1591 moved 0
ordered sort cgs: stationary 1474 moved 0
ordered sort cgs: stationary 1475 moved 0
ordered sort cgs: stationary 1471 moved 0
ordered sort cgs: stationary 1604 moved 0
ordered sort cgs: stationary 1580 moved 0
ordered sort cgs: stationary 1502 moved 0
ordered sort cgs: stationary 1428 moved 0
ordered sort cgs: stationary 1741 moved 0
ordered sort cgs: stationary 1550 moved 1
ordered sort cgs: stationary 1455 moved 0
ordered sort cgs: stationary 1479 moved 0
ordered sort cgs: stationary 1479 moved 0
Set the new home charge group count to 1523
Set the new home charge group count to 1455
Set the new home charge group count to 1442
Set the new home charge group count to 1469
Set the new home charge group count to 1461
Set the new home charge group count to 1493
Set the new home charge group count to 1455
Set the new home charge group count to 1447
Set the new home charge group count to 1461
Set the new home charge group count to 1465
Set the new home charge group count to 1463
Set the new home charge group count to 1462
Set the new home charge group count to 1445
Set the new home charge group count to 1463
Set the new home charge group count to 1466
Set the new home charge group count to 1451
Set the new home charge group count to 1489
Set the new home charge group count to 1695
Set the new home charge group count to 1561
Set the new home charge group count to 1591
Set the new home charge group count to 1474
Set the new home charge group count to 1475
Set the new home charge group count to 1471
Set the new home charge group count to 1604
Set the new home charge group count to 1580
Set the new home charge group count to 1502
Set the new home charge group count to 1428
Set the new home charge group count to 1741
Set the new home charge group count to 1551
Set the new home charge group count to 1455
Set the new home charge group count to 1479
Set the new home charge group count to 1479
Setting up DD communication
Setting up DD communication
Setting up DD communication
Setting up DD communication
Setting up DD communication
Setting up DD communication
Setting up DD communication
Setting up DD communication
Setting up DD communication
Setting up DD communication
Setting up DD communication
Setting up DD communication
Setting up DD communication
Setting up DD communication
Setting up DD communication
Setting up DD communication
Setting up DD communication
Setting up DD communication
Setting up DD communication
Setting up DD communication
Setting up DD communication
Setting up DD communication
Setting up DD communication
Setting up DD communication
Setting up DD communication
Setting up DD communication
Setting up DD communication
Setting up DD communication
Setting up DD communication
bBondComm 0, r_bc 1.400000
Setting up DD communication
Setting up DD communication
bBondComm 0, r_bc 1.400000
bBondComm 0, r_bc 1.400000
bBondComm 0, r_bc 1.400000
bBondComm 0, r_bc 1.400000
Setting up DD communication
bBondComm 0, r_bc 1.400000
bBondComm 0, r_bc 1.400000
bBondComm 0, r_bc 1.400000
bBondComm 0, r_bc 1.400000
bBondComm 0, r_bc 1.400000
bBondComm 0, r_bc 1.400000
bBondComm 0, r_bc 1.400000
bBondComm 0, r_bc 1.400000
bBondComm 0, r_bc 1.400000
bBondComm 0, r_bc 1.400000
bBondComm 0, r_bc 1.400000
bBondComm 0, r_bc 1.400000
bBondComm 0, r_bc 1.400000
bBondComm 0, r_bc 1.400000
bBondComm 0, r_bc 1.400000
bBondComm 0, r_bc 1.400000
bBondComm 0, r_bc 1.400000
bBondComm 0, r_bc 1.400000
bBondComm 0, r_bc 1.400000
bBondComm 0, r_bc 1.400000
bBondComm 0, r_bc 1.400000
bBondComm 0, r_bc 1.400000
bBondComm 0, r_bc 1.400000
bBondComm 0, r_bc 1.400000

skew_fac_01 0.500001
bBondComm 0, r_bc 1.400000
bBondComm 0, r_bc 1.400000

skew_fac_01 0.500001

skew_fac_01 0.500001

skew_fac_01 0.500001

skew_fac_01 0.500001
bBondComm 0, r_bc 1.400000

skew_fac_01 0.500001

skew_fac_01 0.500001

skew_fac_01 0.500001

skew_fac_01 0.500001

skew_fac_01 0.500001

skew_fac_01 0.500001

skew_fac_01 0.500001

skew_fac_01 0.500001

skew_fac_01 0.500001

skew_fac_01 0.500001

skew_fac_01 0.500001

skew_fac_01 0.500001

skew_fac_01 0.500001

skew_fac_01 0.500001

skew_fac_01 0.500001

skew_fac_01 0.500001

skew_fac_01 0.500001

skew_fac_01 0.500001

skew_fac_01 0.500001

skew_fac_01 0.500001

skew_fac_01 0.500001

skew_fac_01 0.500001

skew_fac_01 0.500001

skew_fac_01 0.500001

skew_fac_01 0.500001

skew_fac_01 0.500001

skew_fac_01 0.500001
Finished setting up DD communication, zones:Finished setting up DD communication, zones: 1465 1461 493 519Finished setting up DD communication, zones:Finished setting up DD communication, zones: 180 170 1466 1451 505 502 607 490 59 67 197 168 284 287 502Finished setting up DD communication, zones:Finished setting up DD communication, zones: 502 72 50 67 1445 1463 63 11 16 293 531 497 276

 56 185 172 65 10 511 514 13Making local topology
Making local topology
Finished setting up DD communication, zones:Finished setting up DD communication, zones:
 65 63
Two-body bonded cut-off distance is 1.4
Two-body bonded cut-off distance is 1.4
 1463 1462 300 284dim 0 cellmin 4.021279 bonded rcheck[0] = 0, bRCheck2B = 0
Making local topology
Making local topology
dim 0 cellmin 4.021279 bonded rcheck[0] = 0, bRCheck2B = 0
 501 546 57 62dim 1 cellmin 4.021279 bonded rcheck[1] = 0, bRCheck2B = 0
Two-body bonded cut-off distance is 1.4
Two-body bonded cut-off distance is 1.4
dim 1 cellmin 4.021279 bonded rcheck[1] = 0, bRCheck2B = 0
 176 219 14 15dim 2 cellmin 6.965060 bonded rcheck[2] = 0, bRCheck2B = 0
dim 0 cellmin 4.021279 bonded rcheck[0] = 0, bRCheck2B = 0
dim 0 cellmin 4.021279 bonded rcheck[0] = 0, bRCheck2B = 0
dim 2 cellmin 6.965060 bonded rcheck[2] = 0, bRCheck2B = 0
 511Finished setting up DD communication, zones:Finished setting up DD communication, zones: 524

Finished setting up DD communication, zones:Finished setting up DD communication, zones:dim 1 cellmin 4.021279 bonded rcheck[1] = 0, bRCheck2B = 0
dim 1 cellmin 4.021279 bonded rcheck[1] = 0, bRCheck2B = 0
Finished setting up DD communication, zones:Finished setting up DD communication, zones: 64 1474 1475 68 1604 1471Making local topology
dim 2 cellmin 6.965060 bonded rcheck[2] = 0, bRCheck2B = 0
Making local topology
Finished setting up DD communication, zones:Finished setting up DD communication, zones:dim 2 cellmin 6.965060 bonded rcheck[2] = 0, bRCheck2B = 0
 1591 1561 272Finished setting up DD communication, zones:Finished setting up DD communication, zones: 499 508 291 543 518Two-body bonded cut-off distance is 1.4
Finished setting up DD communication, zones:Finished setting up DD communication, zones:Two-body bonded cut-off distance is 1.4
 1695 1489 501Finished setting up DD communication, zones:Finished setting up DD communication, zones: 508 58 1479Finished setting up DD communication, zones:Finished setting up DD communication, zones: 1479 184 180Finished setting up DD communication, zones:Finished setting up DD communication, zones: 65 176 173Finished setting up DD communication, zones:Finished setting up DD communication, zones:Finished setting up DD communication, zones:Finished setting up DD communication, zones:Finished setting up DD communication, zones:dim 0 cellmin 4.021279 bonded rcheck[0] = 0, bRCheck2B = 0
Finished setting up DD communication, zones: 1493 1461dim 0 cellmin 4.021279 bonded rcheck[0] = 0, bRCheck2B = 0
 553 510 216 1523 1455 180 15 563 1455 1447 507 549 537 1551 1455 15 515 486 1741 1428 1580 1502 1469dim 1 cellmin 4.021279 bonded rcheck[1] = 0, bRCheck2B = 0
 1442 518 507dim 1 cellmin 4.021279 bonded rcheck[1] = 0, bRCheck2B = 0
 204 181 571 509 504 523
 183 495 506 168 60 79 524 511
 65 71 575 557 532 603 517dim 2 cellmin 6.965060 bonded rcheck[2] = 0, bRCheck2B = 0
 491 177 174dim 2 cellmin 6.965060 bonded rcheck[2] = 0, bRCheck2B = 0
 623 522 70 185 182 64 508 172 178 483 293 309Making local topology
 211 194 297 301 198 192 178 226Making local topology
 177 185 502 502 67 70 358 531 522 282 58 508 550 71 65 65Two-body bonded cut-off distance is 1.4
 614 495 69 70 578 493 535 537Two-body bonded cut-off distance is 1.4
 502 512 69 65 310 282 65 65 68 57 303 65 65 274 14 17dim 0 cellmin 4.021279 bonded rcheck[0] = 0, bRCheck2B = 0
 62 74 16 16 58 77 63 71dim 0 cellmin 4.021279 bonded rcheck[0] = 0, bRCheck2B = 0
 61 61 295 292 66 62 15 303 285 15 66 277 295 68

dim 1 cellmin 4.021279 bonded rcheck[1] = 0, bRCheck2B = 0
 282 295

 268 332 279 352dim 1 cellmin 4.021279 bonded rcheck[1] = 0, bRCheck2B = 0
 296 285 60We have 1465 exclusions, check count 0
 63 16 18
 59 60
 16 70 61 19We have 1470 exclusions, check count 6
dim 2 cellmin 6.965060 bonded rcheck[2] = 0, bRCheck2B = 0
 70Making local topology
 77Making local topology
 66 99 66 77We have 1451 exclusions, check count 0
Making local topology
Making local topology
dim 2 cellmin 6.965060 bonded rcheck[2] = 0, bRCheck2B = 0
 60 67 14 14

Constraints: home   0 border   0 atoms:   0
 13 15We have 1628 exclusions, check count 99

 13 13
Making local topology
Making local topology
Constraints: home   0 border   0 atoms:   0
 14Two-body bonded cut-off distance is 1.4
 22Two-body bonded cut-off distance is 1.4
 14 16 15 14Two-body bonded cut-off distance is 1.4
Constraints: home   0 border   0 atoms:   0
Two-body bonded cut-off distance is 1.4
 13 18

Begin setup_specat_communication for constraint


Making local topology
Making local topology


Two-body bonded cut-off distance is 1.4
Two-body bonded cut-off distance is 1.4
Making local topology
Constraints: home   5 border   3 atoms:   3
Begin setup_specat_communication for constraint

Making local topology
dim 0 cellmin 4.021279 bonded rcheck[0] = 0, bRCheck2B = 0

dim 0 cellmin 4.021279 bonded rcheck[0] = 0, bRCheck2B = 0




dim 0 cellmin 4.021279 bonded rcheck[0] = 0, bRCheck2B = 0
Begin setup_specat_communication for constraint
dim 0 cellmin 4.021279 bonded rcheck[0] = 0, bRCheck2B = 0


We have 1463 exclusions, check count 0
Two-body bonded cut-off distance is 1.4
Two-body bonded cut-off distance is 1.4
We have 1479 exclusions, check count 18
Making local topology
Making local topology
dim 0 cellmin 4.021279 bonded rcheck[0] = 0, bRCheck2B = 0
Making local topology
dim 0 cellmin 4.021279 bonded rcheck[0] = 0, bRCheck2B = 0
Making local topology
Two-body bonded cut-off distance is 1.4
Making local topology
Begin setup_specat_communication for constraint
Two-body bonded cut-off distance is 1.4
Making local topology
We have 1463 exclusions, check count 0
dim 1 cellmin 4.021279 bonded rcheck[1] = 0, bRCheck2B = 0
Making local topology
We have 1726 exclusions, check count 143
dim 1 cellmin 4.021279 bonded rcheck[1] = 0, bRCheck2B = 0
Making local topology
dim 1 cellmin 4.021279 bonded rcheck[1] = 0, bRCheck2B = 0
Making local topology
Making local topology
Making local topology
Making local topology
dim 1 cellmin 4.021279 bonded rcheck[1] = 0, bRCheck2B = 0
Constraints: home   0 border   0 atoms:   0
dim 0 cellmin 4.021279 bonded rcheck[0] = 0, bRCheck2B = 0
dim 0 cellmin 4.021279 bonded rcheck[0] = 0, bRCheck2B = 0
Making local topology
Making local topology
Constraints: home   5 border   0 atoms:   0
Two-body bonded cut-off distance is 1.4
Two-body bonded cut-off distance is 1.4
dim 1 cellmin 4.021279 bonded rcheck[1] = 0, bRCheck2B = 0
Two-body bonded cut-off distance is 1.4
dim 1 cellmin 4.021279 bonded rcheck[1] = 0, bRCheck2B = 0
Two-body bonded cut-off distance is 1.4
dim 0 cellmin 4.021279 bonded rcheck[0] = 0, bRCheck2B = 0
Two-body bonded cut-off distance is 1.4
dim 0 cellmin 4.021279 bonded rcheck[0] = 0, bRCheck2B = 0
Two-body bonded cut-off distance is 1.4
Constraints: home   0 border   0 atoms:   0
dim 2 cellmin 6.965060 bonded rcheck[2] = 0, bRCheck2B = 0
Two-body bonded cut-off distance is 1.4
Constraints: home  25 border   9 atoms:   7
dim 2 cellmin 6.965060 bonded rcheck[2] = 0, bRCheck2B = 0
Two-body bonded cut-off distance is 1.4
dim 2 cellmin 6.965060 bonded rcheck[2] = 0, bRCheck2B = 0
Two-body bonded cut-off distance is 1.4
Two-body bonded cut-off distance is 1.4
Two-body bonded cut-off distance is 1.4
Two-body bonded cut-off distance is 1.4
dim 2 cellmin 6.965060 bonded rcheck[2] = 0, bRCheck2B = 0
Begin setup_specat_communication for constraint
dim 1 cellmin 4.021279 bonded rcheck[1] = 0, bRCheck2B = 0
dim 1 cellmin 4.021279 bonded rcheck[1] = 0, bRCheck2B = 0
Two-body bonded cut-off distance is 1.4
Two-body bonded cut-off distance is 1.4
Begin setup_specat_communication for constraint
dim 0 cellmin 4.021279 bonded rcheck[0] = 0, bRCheck2B = 0
dim 0 cellmin 4.021279 bonded rcheck[0] = 0, bRCheck2B = 0
dim 2 cellmin 6.965060 bonded rcheck[2] = 0, bRCheck2B = 0
dim 0 cellmin 4.021279 bonded rcheck[0] = 0, bRCheck2B = 0
dim 2 cellmin 6.965060 bonded rcheck[2] = 0, bRCheck2B = 0
dim 0 cellmin 4.021279 bonded rcheck[0] = 0, bRCheck2B = 0
dim 1 cellmin 4.021279 bonded rcheck[1] = 0, bRCheck2B = 0
dim 0 cellmin 4.021279 bonded rcheck[0] = 0, bRCheck2B = 0
dim 1 cellmin 4.021279 bonded rcheck[1] = 0, bRCheck2B = 0
dim 0 cellmin 4.021279 bonded rcheck[0] = 0, bRCheck2B = 0
Begin setup_specat_communication for constraint
dim 0 cellmin 4.021279 bonded rcheck[0] = 0, bRCheck2B = 0
Begin setup_specat_communication for constraint
dim 0 cellmin 4.021279 bonded rcheck[0] = 0, bRCheck2B = 0
dim 0 cellmin 4.021279 bonded rcheck[0] = 0, bRCheck2B = 0
dim 0 cellmin 4.021279 bonded rcheck[0] = 0, bRCheck2B = 0
dim 0 cellmin 4.021279 bonded rcheck[0] = 0, bRCheck2B = 0
dim 0 cellmin 4.021279 bonded rcheck[0] = 0, bRCheck2B = 0
dim 2 cellmin 6.965060 bonded rcheck[2] = 0, bRCheck2B = 0
dim 2 cellmin 6.965060 bonded rcheck[2] = 0, bRCheck2B = 0
dim 0 cellmin 4.021279 bonded rcheck[0] = 0, bRCheck2B = 0
dim 0 cellmin 4.021279 bonded rcheck[0] = 0, bRCheck2B = 0
dim 1 cellmin 4.021279 bonded rcheck[1] = 0, bRCheck2B = 0
dim 1 cellmin 4.021279 bonded rcheck[1] = 0, bRCheck2B = 0
We have 1643 exclusions, check count 92
dim 1 cellmin 4.021279 bonded rcheck[1] = 0, bRCheck2B = 0
dim 1 cellmin 4.021279 bonded rcheck[1] = 0, bRCheck2B = 0
dim 2 cellmin 6.965060 bonded rcheck[2] = 0, bRCheck2B = 0
dim 1 cellmin 4.021279 bonded rcheck[1] = 0, bRCheck2B = 0
dim 2 cellmin 6.965060 bonded rcheck[2] = 0, bRCheck2B = 0
dim 1 cellmin 4.021279 bonded rcheck[1] = 0, bRCheck2B = 0
dim 1 cellmin 4.021279 bonded rcheck[1] = 0, bRCheck2B = 0
dim 1 cellmin 4.021279 bonded rcheck[1] = 0, bRCheck2B = 0
dim 1 cellmin 4.021279 bonded rcheck[1] = 0, bRCheck2B = 0
dim 1 cellmin 4.021279 bonded rcheck[1] = 0, bRCheck2B = 0
dim 1 cellmin 4.021279 bonded rcheck[1] = 0, bRCheck2B = 0
dim 1 cellmin 4.021279 bonded rcheck[1] = 0, bRCheck2B = 0
dim 1 cellmin 4.021279 bonded rcheck[1] = 0, bRCheck2B = 0
dim 1 cellmin 4.021279 bonded rcheck[1] = 0, bRCheck2B = 0
dim 2 cellmin 6.965060 bonded rcheck[2] = 0, bRCheck2B = 0
dim 2 cellmin 6.965060 bonded rcheck[2] = 0, bRCheck2B = 0
dim 2 cellmin 6.965060 bonded rcheck[2] = 0, bRCheck2B = 0
Constraints: home  14 border   7 atoms:   5
dim 2 cellmin 6.965060 bonded rcheck[2] = 0, bRCheck2B = 0
dim 2 cellmin 6.965060 bonded rcheck[2] = 0, bRCheck2B = 0
dim 2 cellmin 6.965060 bonded rcheck[2] = 0, bRCheck2B = 0
dim 2 cellmin 6.965060 bonded rcheck[2] = 0, bRCheck2B = 0
dim 2 cellmin 6.965060 bonded rcheck[2] = 0, bRCheck2B = 0
dim 2 cellmin 6.965060 bonded rcheck[2] = 0, bRCheck2B = 0
dim 2 cellmin 6.965060 bonded rcheck[2] = 0, bRCheck2B = 0
dim 2 cellmin 6.965060 bonded rcheck[2] = 0, bRCheck2B = 0
dim 2 cellmin 6.965060 bonded rcheck[2] = 0, bRCheck2B = 0
dim 2 cellmin 6.965060 bonded rcheck[2] = 0, bRCheck2B = 0
dim 2 cellmin 6.965060 bonded rcheck[2] = 0, bRCheck2B = 0
We have 1549 exclusions, check count 48
Begin setup_specat_communication for constraint
Constraints: home   3 border   2 atoms:   2
Begin setup_specat_communication for constraint
We have 2360 exclusions, check count 389
Constraints: home  67 border  10 atoms:   9
Begin setup_specat_communication for constraint
We have 1474 exclusions, check count 3
Constraints: home   0 border   0 atoms:   0
Begin setup_specat_communication for constraint
We have 2511 exclusions, check count 492
Constraints: home  79 border  17 atoms:  14
Begin setup_specat_communication for constraint
We have 2050 exclusions, check count 246
Constraints: home  48 border  15 atoms:  11
Begin setup_specat_communication for constraint
We have 1573 exclusions, check count 42
Constraints: home   7 border   0 atoms:   0
Begin setup_specat_communication for constraint
We have 3298 exclusions, check count 836
Constraints: home 143 border  19 atoms:  17
Begin setup_specat_communication for constraint
We have 1687 exclusions, check count 113
Constraints: home  21 border   3 atoms:   3
Begin setup_specat_communication for constraint
We have 1515 exclusions, check count 18
Constraints: home   0 border   1 atoms:   1
Begin setup_specat_communication for constraint
We have 1476 exclusions, check count 8
We have 1611 exclusions, check count 59
Constraints: home   0 border   0 atoms:   0
Constraints: home  10 border   6 atoms:   5
Begin setup_specat_communication for constraint
Begin setup_specat_communication for constraint
We have 1822 exclusions, check count 152
We have 1455 exclusions, check count 0
Constraints: home  20 border   4 atoms:   3
Constraints: home   0 border   0 atoms:   0
We have 1455 exclusions, check count 0
Begin setup_specat_communication for constraint
Begin setup_specat_communication for constraint
We have 1479 exclusions, check count 18
We have 1460 exclusions, check count 4
We have 2250 exclusions, check count 374
Constraints: home   0 border   0 atoms:   0
Constraints: home   1 border   9 atoms:   6
Begin setup_specat_communication for constraint
Constraints: home   0 border   0 atoms:   0
Begin setup_specat_communication for constraint
Constraints: home  50 border  17 atoms:  13
Begin setup_specat_communication for constraint
We have 1589 exclusions, check count 92
Begin setup_specat_communication for constraint
We have 2370 exclusions, check count 403
Constraints: home  13 border   2 atoms:   2
We have 1469 exclusions, check count 0
Begin setup_specat_communication for constraint
We have 3450 exclusions, check count 890
We have 1442 exclusions, check count 0
We have 1974 exclusions, check count 269
Constraints: home  73 border  11 atoms:   9
Constraints: home   0 border   0 atoms:   0
Constraints: home   0 border   0 atoms:   0
Constraints: home 142 border  27 atoms:  22
Constraints: home  34 border  14 atoms:  12
Begin setup_specat_communication for constraint
Begin setup_specat_communication for constraint
Begin setup_specat_communication for constraint
Begin setup_specat_communication for constraint
Begin setup_specat_communication for constraint
Communicated the counts
Communicated the counts
Communicated the counts
Communicated the counts
Communicated the counts
Communicated the counts
Communicated the counts
Communicated the counts
Communicated the counts
Communicated the counts
Communicated the counts
Communicated the counts
Communicated the counts
Communicated the counts
Communicated the counts
Communicated the counts
dim=0, dir=1, searching for 10 atoms
Communicated the counts
Communicated the counts
Communicated the counts
Communicated the counts
Communicated the counts
Communicated the counts
Communicated the counts
Communicated the counts
Communicated the counts
Communicated the counts
Communicated the counts
Communicated the counts
dim=0, dir=1, searching for 41 atoms
Communicated the counts
Communicated the counts
Communicated the counts
Communicated the counts
dim=0, dir=1, searching for 14 atoms
dim=0, dir=1, searching for 3 atoms
dim=0, dir=1, searching for 38 atoms
dim=0, dir=1, searching for 7 atoms
dim=0, dir=1, searching for 49 atoms
dim=0, dir=1, searching for 9 atoms
dim=0, dir=1, searching for 33 atoms
dim=0, dir=1, searching for 51 atoms
dim=0, dir=1, searching for 10 atoms
dim=0, dir=1, searching for 8 atoms
dim=0, dir=1, searching for 41 atoms
dim=0, dir=1, searching for 11 atoms
dim=0, dir=1, searching for 49 atoms
dim=0, dir=1, searching for 58 atoms
dim=0, dir=1, searching for 3 atoms
dim=0, dir=1, searching for 51 atoms
dim=0, dir=1, searching for 49 atoms
dim=0, dir=1, searching for 10 atoms
dim=0, dir=1, searching for 9 atoms
dim=0, dir=1, searching for 14 atoms
dim=0, dir=1, searching for 49 atoms
dim=0, dir=1, searching for 58 atoms
dim=0, dir=1, searching for 10 atoms
dim=0, dir=1, searching for 41 atoms
dim=0, dir=1, searching for 41 atoms
dim=0, dir=1, searching for 11 atoms
dim=0, dir=1, searching for 8 atoms
dim=0, dir=1, searching for 38 atoms
dim=0, dir=1, searching for 7 atoms
dim=0, dir=1, searching for 33 atoms
Send to node 4, 0 (0) indices, receive from node 20, 2 (2) indices
Send to node 14, 0 (0) indices, receive from node 30, 0 (0) indices
Send to node 12, 0 (0) indices, receive from node 28, 0 (0) indices
Send to node 20, 4 (4) indices, receive from node 4, 0 (0) indices
Send to node 28, 2 (2) indices, receive from node 12, 4 (4) indices
Send to node 22, 0 (0) indices, receive from node 6, 0 (0) indices
Send to node 30, 5 (5) indices, receive from node 14, 0 (0) indices
Send to node 6, 0 (0) indices, receive from node 22, 5 (5) indices
Send to node 8, 0 (0) indices, receive from node 24, 0 (0) indices
Send to node 0, 0 (0) indices, receive from node 16, 0 (0) indices
Send to node 16, 0 (0) indices, receive from node 0, 0 (0) indices
Send to node 24, 0 (0) indices, receive from node 8, 0 (0) indices
Send to node 26, 4 (4) indices, receive from node 10, 0 (0) indices
Send to node 18, 0 (0) indices, receive from node 2, 0 (0) indices
Send to node 2, 0 (0) indices, receive from node 18, 4 (4) indices
Send to node 10, 0 (0) indices, receive from node 26, 0 (0) indices
Send to node 27, 0 (0) indices, receive from node 11, 5 (4) indices
Send to node 29, 0 (0) indices, receive from node 13, 0 (0) indices
Send to node 21, 0 (0) indices, receive from node 5, 0 (0) indices
Send to node 13, 0 (0) indices, receive from node 29, 0 (0) indices
Send to node 5, 0 (0) indices, receive from node 21, 0 (0) indices
Send to node 19, 5 (4) indices, receive from node 3, 2 (2) indices
Send to node 3, 0 (0) indices, receive from node 19, 0 (0) indices
Send to node 11, 2 (2) indices, receive from node 27, 0 (0) indices
Send to node 9, 4 (4) indices, receive from node 25, 0 (0) indices
Send to node 1, 0 (0) indices, receive from node 17, 0 (0) indices
Send to node 25, 0 (0) indices, receive from node 9, 0 (0) indices
Send to node 17, 0 (0) indices, receive from node 1, 4 (4) indices
Send to node 7, 0 (0) indices, receive from node 23, 0 (0) indices
Send to node 15, 0 (0) indices, receive from node 31, 0 (0) indices
Send to node 31, 0 (0) indices, receive from node 15, 0 (0) indices
Send to node 23, 0 (0) indices, receive from node 7, 0 (0) indices
dim=0, dir=0, searching for 8 atoms
dim=0, dir=0, searching for 14 atoms
dim=0, dir=0, searching for 51 atoms
dim=0, dir=0, searching for 3 atoms
dim=0, dir=0, searching for 49 atoms
dim=0, dir=0, searching for 7 atoms
dim=0, dir=0, searching for 33 atoms
dim=0, dir=0, searching for 38 atoms
dim=0, dir=0, searching for 11 atoms
dim=0, dir=0, searching for 41 atoms
dim=0, dir=0, searching for 10 atoms
dim=0, dir=0, searching for 41 atoms
dim=0, dir=0, searching for 10 atoms
dim=0, dir=0, searching for 49 atoms
dim=0, dir=0, searching for 58 atoms
dim=0, dir=0, searching for 9 atoms
dim=0, dir=0, searching for 49 atoms
dim=0, dir=0, searching for 3 atoms
dim=0, dir=0, searching for 14 atoms
dim=0, dir=0, searching for 51 atoms
dim=0, dir=0, searching for 58 atoms
dim=0, dir=0, searching for 49 atoms
dim=0, dir=0, searching for 9 atoms
dim=0, dir=0, searching for 10 atoms
dim=0, dir=0, searching for 41 atoms
dim=0, dir=0, searching for 41 atoms
dim=0, dir=0, searching for 10 atoms
dim=0, dir=0, searching for 11 atoms
dim=0, dir=0, searching for 33 atoms
dim=0, dir=0, searching for 8 atoms
dim=0, dir=0, searching for 38 atoms
dim=0, dir=0, searching for 7 atoms
Send to node 28, 0 (0) indices, receive from node 12, 0 (0) indices
Send to node 20, 2 (2) indices, receive from node 4, 0 (0) indices
Send to node 4, 0 (0) indices, receive from node 20, 3 (3) indices
Send to node 12, 3 (3) indices, receive from node 28, 2 (2) indices
Send to node 30, 0 (0) indices, receive from node 14, 0 (0) indices
Send to node 6, 0 (0) indices, receive from node 22, 0 (0) indices
Send to node 14, 0 (0) indices, receive from node 30, 4 (4) indices
Send to node 22, 4 (4) indices, receive from node 6, 0 (0) indices
Send to node 24, 0 (0) indices, receive from node 8, 0 (0) indices
Send to node 8, 0 (0) indices, receive from node 24, 0 (0) indices
Send to node 16, 0 (0) indices, receive from node 0, 0 (0) indices
Send to node 0, 0 (0) indices, receive from node 16, 0 (0) indices
Send to node 10, 1 (0) indices, receive from node 26, 4 (4) indices
Send to node 18, 4 (4) indices, receive from node 2, 0 (0) indices
Send to node 26, 0 (0) indices, receive from node 10, 0 (0) indices
Send to node 2, 0 (0) indices, receive from node 18, 1 (0) indices
Send to node 5, 0 (0) indices, receive from node 21, 0 (0) indices
Send to node 13, 0 (0) indices, receive from node 29, 0 (0) indices
Send to node 21, 0 (0) indices, receive from node 5, 0 (0) indices
Send to node 29, 0 (0) indices, receive from node 13, 0 (0) indices
Send to node 19, 0 (0) indices, receive from node 3, 0 (0) indices
Send to node 27, 0 (0) indices, receive from node 11, 2 (2) indices
Send to node 11, 6 (6) indices, receive from node 27, 0 (0) indices
Send to node 3, 2 (2) indices, receive from node 19, 6 (6) indices
Send to node 9, 0 (0) indices, receive from node 25, 0 (0) indices
Send to node 17, 0 (0) indices, receive from node 1, 0 (0) indices
Send to node 1, 6 (6) indices, receive from node 17, 0 (0) indices
Send to node 25, 0 (0) indices, receive from node 9, 6 (6) indices
Send to node 23, 0 (0) indices, receive from node 7, 0 (0) indices
Send to node 7, 0 (0) indices, receive from node 23, 0 (0) indices
Send to node 31, 0 (0) indices, receive from node 15, 0 (0) indices
Send to node 15, 0 (0) indices, receive from node 31, 0 (0) indices
dim=1, dir=1, searching for 0 atoms
dim=1, dir=1, searching for 4 atoms
dim=1, dir=1, searching for 9 atoms
dim=1, dir=1, searching for 5 atoms
dim=1, dir=1, searching for 7 atoms
dim=1, dir=1, searching for 13 atoms
dim=1, dir=1, searching for 7 atoms
dim=1, dir=1, searching for 0 atoms
dim=1, dir=1, searching for 3 atoms
dim=1, dir=1, searching for 25 atoms
dim=1, dir=1, searching for 6 atoms
dim=1, dir=1, searching for 24 atoms
dim=1, dir=1, searching for 3 atoms
dim=1, dir=1, searching for 0 atoms
dim=1, dir=1, searching for 17 atoms
dim=1, dir=1, searching for 21 atoms
dim=1, dir=1, searching for 4 atoms
dim=1, dir=1, searching for 9 atoms
dim=1, dir=1, searching for 5 atoms
dim=1, dir=1, searching for 0 atoms
dim=1, dir=1, searching for 3 atoms
dim=1, dir=1, searching for 0 atoms
dim=1, dir=1, searching for 17 atoms
dim=1, dir=1, searching for 21 atoms
dim=1, dir=1, searching for 25 atoms
dim=1, dir=1, searching for 6 atoms
dim=1, dir=1, searching for 3 atoms
dim=1, dir=1, searching for 24 atoms
dim=1, dir=1, searching for 0 atoms
dim=1, dir=1, searching for 13 atoms
dim=1, dir=1, searching for 7 atoms
dim=1, dir=1, searching for 7 atoms
Send to node 0, 0 (0) indices, receive from node 4, 0 (0) indices
Send to node 16, 0 (0) indices, receive from node 20, 5 (5) indices
Send to node 24, 0 (0) indices, receive from node 28, 0 (0) indices
Send to node 8, 0 (0) indices, receive from node 12, 2 (2) indices
Send to node 30, 0 (0) indices, receive from node 26, 1 (1) indices
Send to node 26, 0 (0) indices, receive from node 30, 0 (0) indices
Send to node 28, 1 (1) indices, receive from node 24, 0 (0) indices
Send to node 6, 0 (0) indices, receive from node 2, 0 (0) indices
Send to node 4, 0 (0) indices, receive from node 0, 0 (0) indices
Send to node 2, 0 (0) indices, receive from node 6, 0 (0) indices
Send to node 22, 5 (5) indices, receive from node 18, 6 (6) indices
Send to node 18, 1 (1) indices, receive from node 22, 0 (0) indices
Send to node 20, 6 (6) indices, receive from node 16, 1 (1) indices
Send to node 10, 0 (0) indices, receive from node 14, 0 (0) indices
Send to node 12, 1 (1) indices, receive from node 8, 0 (0) indices
Send to node 14, 2 (2) indices, receive from node 10, 1 (1) indices
Send to node 21, 0 (0) indices, receive from node 17, 4 (4) indices
Send to node 29, 0 (0) indices, receive from node 25, 0 (0) indices
Send to node 5, 0 (0) indices, receive from node 1, 1 (1) indices
Send to node 13, 4 (4) indices, receive from node 9, 7 (7) indices
Send to node 25, 0 (0) indices, receive from node 29, 0 (0) indices
Send to node 31, 0 (0) indices, receive from node 27, 0 (0) indices
Send to node 27, 0 (0) indices, receive from node 31, 0 (0) indices
Send to node 11, 7 (7) indices, receive from node 15, 0 (0) indices
Send to node 9, 0 (0) indices, receive from node 13, 0 (0) indices
Send to node 15, 0 (0) indices, receive from node 11, 4 (4) indices
Send to node 3, 1 (1) indices, receive from node 7, 0 (0) indices
Send to node 1, 0 (0) indices, receive from node 5, 0 (0) indices
Send to node 7, 0 (0) indices, receive from node 3, 0 (0) indices
Send to node 17, 0 (0) indices, receive from node 21, 0 (0) indices
Send to node 23, 0 (0) indices, receive from node 19, 0 (0) indices
Send to node 19, 4 (4) indices, receive from node 23, 0 (0) indices
dim=1, dir=0, searching for 0 atoms
dim=1, dir=0, searching for 3 atoms
dim=1, dir=0, searching for 5 atoms
dim=1, dir=0, searching for 6 atoms
dim=1, dir=0, searching for 0 atoms
dim=1, dir=0, searching for 3 atoms
dim=1, dir=0, searching for 7 atoms
dim=1, dir=0, searching for 0 atoms
dim=1, dir=0, searching for 17 atoms
dim=1, dir=0, searching for 9 atoms
dim=1, dir=0, searching for 7 atoms
dim=1, dir=0, searching for 25 atoms
dim=1, dir=0, searching for 4 atoms
dim=1, dir=0, searching for 13 atoms
dim=1, dir=0, searching for 24 atoms
dim=1, dir=0, searching for 21 atoms
dim=1, dir=0, searching for 0 atoms
dim=1, dir=0, searching for 3 atoms
dim=1, dir=0, searching for 6 atoms
dim=1, dir=0, searching for 5 atoms
dim=1, dir=0, searching for 4 atoms
dim=1, dir=0, searching for 21 atoms
dim=1, dir=0, searching for 13 atoms
dim=1, dir=0, searching for 24 atoms
dim=1, dir=0, searching for 0 atoms
dim=1, dir=0, searching for 7 atoms
dim=1, dir=0, searching for 0 atoms
dim=1, dir=0, searching for 3 atoms
dim=1, dir=0, searching for 17 atoms
dim=1, dir=0, searching for 25 atoms
dim=1, dir=0, searching for 9 atoms
dim=1, dir=0, searching for 7 atoms
Send to node 28, 0 (0) indices, receive from node 24, 0 (0) indices
Send to node 24, 0 (0) indices, receive from node 28, 2 (2) indices
Send to node 30, 0 (0) indices, receive from node 26, 0 (0) indices
Send to node 26, 2 (2) indices, receive from node 30, 0 (0) indices
Send to node 2, 0 (0) indices, receive from node 6, 0 (0) indices
Send to node 6, 0 (0) indices, receive from node 2, 0 (0) indices
Send to node 0, 0 (0) indices, receive from node 4, 0 (0) indices
Send to node 4, 0 (0) indices, receive from node 0, 0 (0) indices
Send to node 22, 0 (0) indices, receive from node 18, 1 (1) indices
Send to node 20, 5 (5) indices, receive from node 16, 0 (0) indices
Send to node 16, 1 (1) indices, receive from node 20, 5 (5) indices
Send to node 18, 5 (5) indices, receive from node 22, 5 (5) indices
Send to node 8, 0 (0) indices, receive from node 12, 1 (1) indices
Send to node 10, 1 (1) indices, receive from node 14, 2 (2) indices
Send to node 14, 0 (0) indices, receive from node 10, 0 (0) indices
Send to node 12, 2 (2) indices, receive from node 8, 0 (0) indices
Send to node 27, 0 (0) indices, receive from node 31, 0 (0) indices
Send to node 31, 0 (0) indices, receive from node 27, 0 (0) indices
Send to node 25, 0 (0) indices, receive from node 29, 0 (0) indices
Send to node 29, 0 (0) indices, receive from node 25, 0 (0) indices
Send to node 15, 0 (0) indices, receive from node 11, 9 (9) indices
Send to node 13, 0 (0) indices, receive from node 9, 0 (0) indices
Send to node 11, 5 (5) indices, receive from node 15, 0 (0) indices
Send to node 9, 9 (9) indices, receive from node 13, 5 (5) indices
Send to node 7, 0 (0) indices, receive from node 3, 1 (1) indices
Send to node 1, 1 (1) indices, receive from node 5, 0 (0) indices
Send to node 5, 0 (0) indices, receive from node 1, 0 (0) indices
Send to node 3, 0 (0) indices, receive from node 7, 0 (0) indices
Send to node 21, 0 (0) indices, receive from node 17, 0 (0) indices
Send to node 23, 0 (0) indices, receive from node 19, 4 (4) indices
Send to node 17, 4 (4) indices, receive from node 21, 0 (0) indices
Send to node 19, 0 (0) indices, receive from node 23, 0 (0) indices
dim=2, dir=0, searching for 0 atoms
dim=2, dir=0, searching for 0 atoms
dim=2, dir=0, searching for 0 atoms
dim=2, dir=0, searching for 0 atoms
dim=2, dir=0, searching for 0 atoms
dim=2, dir=0, searching for 7 atoms
dim=2, dir=0, searching for 3 atoms
dim=2, dir=0, searching for 0 atoms
dim=2, dir=0, searching for 5 atoms
dim=2, dir=0, searching for 11 atoms
dim=2, dir=0, searching for 0 atoms
dim=2, dir=0, searching for 0 atoms
dim=2, dir=0, searching for 22 atoms
dim=2, dir=0, searching for 13 atoms
dim=2, dir=0, searching for 9 atoms
dim=2, dir=0, searching for 1 atoms
dim=2, dir=0, searching for 3 atoms
dim=2, dir=0, searching for 0 atoms
dim=2, dir=0, searching for 6 atoms
dim=2, dir=0, searching for 5 atoms
dim=2, dir=0, searching for 3 atoms
dim=2, dir=0, searching for 12 atoms
dim=2, dir=0, searching for 0 atoms
dim=2, dir=0, searching for 2 atoms
dim=2, dir=0, searching for 0 atoms
dim=2, dir=0, searching for 0 atoms
dim=2, dir=0, searching for 0 atoms
dim=2, dir=0, searching for 0 atoms
dim=2, dir=0, searching for 9 atoms
dim=2, dir=0, searching for 2 atoms
dim=2, dir=0, searching for 14 atoms
dim=2, dir=0, searching for 17 atoms
Send to node 29, 0 (0) indices, receive from node 29, 0 (0) indices
Send to node 28, 0 (0) indices, receive from node 28, 0 (0) indices
Send to node 25, 0 (0) indices, receive from node 25, 0 (0) indices
Send to node 24, 0 (0) indices, receive from node 24, 0 (0) indices
Send to node 26, 0 (0) indices, receive from node 26, 0 (0) indices
Send to node 27, 0 (0) indices, receive from node 27, 0 (0) indices
Send to node 30, 0 (0) indices, receive from node 30, 0 (0) indices
Send to node 31, 0 (0) indices, receive from node 31, 0 (0) indices
Send to node 14, 1 (1) indices, receive from node 14, 1 (1) indices
Send to node 15, 1 (1) indices, receive from node 15, 1 (1) indices
Send to node 12, 6 (6) indices, receive from node 12, 5 (5) indices
Send to node 13, 5 (5) indices, receive from node 13, 6 (6) indices
Send to node 8, 0 (0) indices, receive from node 8, 0 (0) indices
Send to node 9, 0 (0) indices, receive from node 9, 0 (0) indices
Send to node 10, 1 (1) indices, receive from node 10, 2 (2) indices
Send to node 11, 2 (2) indices, receive from node 11, 1 (1) indices
Send to node 2, 0 (0) indices, receive from node 2, 0 (0) indices
Send to node 3, 0 (0) indices, receive from node 3, 0 (0) indices
Send to node 0, 0 (0) indices, receive from node 0, 0 (0) indices
Send to node 1, 0 (0) indices, receive from node 1, 0 (0) indices
Send to node 7, 0 (0) indices, receive from node 7, 0 (0) indices
Send to node 6, 0 (0) indices, receive from node 6, 0 (0) indices
Send to node 4, 0 (0) indices, receive from node 4, 0 (0) indices
Send to node 5, 0 (0) indices, receive from node 5, 0 (0) indices
Send to node 22, 0 (0) indices, receive from node 22, 0 (0) indices
Send to node 23, 0 (0) indices, receive from node 23, 0 (0) indices
Send to node 16, 1 (1) indices, receive from node 16, 1 (1) indices
Send to node 17, 1 (1) indices, receive from node 17, 1 (1) indices
Send to node 18, 4 (4) indices, receive from node 18, 3 (3) indices
Send to node 19, 3 (3) indices, receive from node 19, 4 (4) indices
Send to node 20, 0 (0) indices, receive from node 20, 0 (0) indices
Send to node 21, 0 (0) indices, receive from node 21, 0 (0) indices
Done setup_specat_communication
Done setup_specat_communication
Done setup_specat_communication
Done setup_specat_communication
Done setup_specat_communication
Done setup_specat_communication
Done setup_specat_communication
Done setup_specat_communication
Done setup_specat_communication
Done setup_specat_communication
Done setup_specat_communication
Done setup_specat_communication
Done setup_specat_communication
Done setup_specat_communication
Done setup_specat_communication
Done setup_specat_communication
Done setup_specat_communication
Done setup_specat_communication
Done setup_specat_communication
Done setup_specat_communication
Done setup_specat_communication
Done setup_specat_communication
Done setup_specat_communication
Done setup_specat_communication
Done setup_specat_communication
Done setup_specat_communication
Done setup_specat_communication
Done setup_specat_communication
Done setup_specat_communication
Done setup_specat_communication
Done setup_specat_communication
Done setup_specat_communication
Building the LINCS connectivity
Number of constraints is 24, couplings 24
Of the 24 constraints 12 participate in triangles
There are 24 couplings of which 24 in triangles
Building the LINCS connectivity
Number of constraints is 10, couplings 18
Of the 10 constraints 9 participate in triangles
There are 18 couplings of which 18 in triangles
Building the LINCS connectivity
Building the LINCS connectivity
Number of constraints is 16, couplings 24
Of the 16 constraints 12 participate in triangles
Number of constraints is 1, couplings 0
There are 24 couplings of which 24 in triangles
Of the 1 constraints 0 participate in triangles
There are 0 couplings of which 0 in triangles
Building the LINCS connectivity
Building the LINCS connectivity
Building the LINCS connectivity
Building the LINCS connectivity
Number of constraints is 24, couplings 30
Of the 24 constraints 15 participate in triangles
Building the LINCS connectivity
There are 30 couplings of which 30 in triangles
Building the LINCS connectivity
Building the LINCS connectivity
Number of constraints is 48, couplings 42
Of the 48 constraints 21 participate in triangles
There are 42 couplings of which 42 in triangles
Building the LINCS connectivity
Building the LINCS connectivity
Number of constraints is 67, couplings 78
Building the LINCS connectivity
Of the 67 constraints 39 participate in triangles
Building the LINCS connectivity
There are 78 couplings of which 78 in triangles
Number of constraints is 15, couplings 12
Building the LINCS connectivity
Number of constraints is 84, couplings 84
Building the LINCS connectivity
Of the 15 constraints 6 participate in triangles
Building the LINCS connectivity
Number of constraints is 169, couplings 138
Building the LINCS connectivity
Of the 84 constraints 42 participate in triangles
There are 12 couplings of which 12 in triangles
Number of constraints is 5, couplings 6
Building the LINCS connectivity
Number of constraints is 8, couplings 0
Number of constraints is 34, couplings 42
Of the 169 constraints 69 participate in triangles
Number of constraints is 77, couplings 84
Number of constraints is 21, couplings 36
There are 84 couplings of which 84 in triangles
Number of constraints is 96, couplings 84
Number of constraints is 5, couplings 0
Of the 5 constraints 3 participate in triangles
Number of constraints is 7, couplings 6
Number of constraints is 63, couplings 84
Of the 8 constraints 0 participate in triangles
Number of constraints is 162, couplings 132
Of the 34 constraints 21 participate in triangles
There are 138 couplings of which 138 in triangles
Of the 77 constraints 42 participate in triangles
Of the 21 constraints 18 participate in triangles
Of the 96 constraints 42 participate in triangles
Of the 5 constraints 0 participate in triangles
There are 6 couplings of which 6 in triangles
Of the 7 constraints 3 participate in triangles
Of the 63 constraints 42 participate in triangles
There are 0 couplings of which 0 in triangles
Of the 162 constraints 66 participate in triangles
There are 42 couplings of which 42 in triangles
There are 84 couplings of which 84 in triangles
There are 36 couplings of which 36 in triangles
There are 84 couplings of which 84 in triangles
There are 0 couplings of which 0 in triangles
There are 6 couplings of which 6 in triangles
There are 84 couplings of which 84 in triangles
There are 132 couplings of which 132 in triangles
NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Particle-Particle interactions,
with 1445 SR, 0 LR atoms.
NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Particle-Particle interactions,
with 1463 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Particle-Particle interactions,
with 1451 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Particle-Particle interactions,
with 1463 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Particle-Particle interactions,
with 1462 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Particle-Particle interactions,
with 1461 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Particle-Particle interactions,
with 1465 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Particle-Particle interactions,
with 1466 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Particle-Particle interactions,
with 1474 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Particle-Particle interactions,
with 1475 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Particle-Particle interactions,
with 1551 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Particle-Particle interactions,
with 1455 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Particle-Particle interactions,
with 1469 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Particle-Particle interactions,
with 1442 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Particle-Particle interactions,
with 1428 SR, 0 LR atoms.
NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Particle-Particle interactions,
with 1741 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Particle-Particle interactions,
with 1591 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Particle-Particle interactions,
with 1479 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Particle-Particle interactions,
with 1479 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Particle-Particle interactions,
with 1561 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Particle-Particle interactions,
with 1461 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Particle-Particle interactions,
with 1455 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Particle-Particle interactions,
with 1447 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Particle-Particle interactions,
with 1493 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Particle-Particle interactions,
with 1695 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Particle-Particle interactions,
with 1489 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Particle-Particle interactions,
with 1455 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Particle-Particle interactions,
with 1502 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Particle-Particle interactions,
with 1523 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Particle-Particle interactions,
with 1580 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Particle-Particle interactions,
with 1604 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Particle-Particle interactions,
with 1471 SR, 0 LR atoms.
NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Particle-Particle interactions,
with 1445 SR, 0 LR atoms.
NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Particle-Particle interactions,
with 1463 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Particle-Particle interactions,
with 1451 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Particle-Particle interactions,
with 1463 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Particle-Particle interactions,
with 1462 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Particle-Particle interactions,
with 1461 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Particle-Particle interactions,
with 1465 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Particle-Particle interactions,
with 1466 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Particle-Particle interactions,
with 1474 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Particle-Particle interactions,
with 1475 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Particle-Particle interactions,
with 1551 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Particle-Particle interactions,
with 1455 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Particle-Particle interactions,
with 1469 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Particle-Particle interactions,
with 1442 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Particle-Particle interactions,
with 1428 SR, 0 LR atoms.
NB kernel nb_kernel_ElecNone_VdwCSTab_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'None', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Particle-Particle interactions,
with 1741 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Particle-Particle interactions,
with 1591 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Particle-Particle interactions,
with 1479 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Particle-Particle interactions,
with 1479 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Particle-Particle interactions,
with 1561 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Particle-Particle interactions,
with 1461 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Particle-Particle interactions,
with 1455 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Particle-Particle interactions,
with 1447 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Particle-Particle interactions,
with 1493 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Particle-Particle interactions,
with 1695 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Particle-Particle interactions,
with 1489 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Particle-Particle interactions,
with 1455 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Particle-Particle interactions,
with 1502 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Particle-Particle interactions,
with 1523 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Particle-Particle interactions,
with 1580 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Particle-Particle interactions,
with 1604 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Particle-Particle interactions,
with 1471 SR, 0 LR atoms.
NB kernel nb_kernel_ElecNone_VdwCSTab_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'None', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecNone_VdwCSTab_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'None', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecNone_VdwCSTab_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'None', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecNone_VdwCSTab_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'None', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecNone_VdwCSTab_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'None', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecNone_VdwCSTab_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'None', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecNone_VdwCSTab_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'None', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecNone_VdwCSTab_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'None', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecNone_VdwCSTab_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'None', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecNone_VdwCSTab_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'None', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecNone_VdwCSTab_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'None', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecNone_VdwCSTab_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'None', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecNone_VdwCSTab_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'None', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecNone_VdwCSTab_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'None', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecNone_VdwCSTab_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'None', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecNone_VdwCSTab_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'None', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecNone_VdwCSTab_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'None', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecNone_VdwCSTab_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'None', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecNone_VdwCSTab_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'None', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecNone_VdwCSTab_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'None', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecNone_VdwCSTab_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'None', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecNone_VdwCSTab_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'None', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecNone_VdwCSTab_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'None', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecNone_VdwCSTab_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'None', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecNone_VdwCSTab_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'None', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecNone_VdwCSTab_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'None', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecNone_VdwCSTab_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'None', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecNone_VdwCSTab_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'None', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecNone_VdwCSTab_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'None', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecNone_VdwCSTab_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'None', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecNone_VdwCSTab_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'None', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecNone_VdwCSTab_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'None', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecNone_VdwCSTab_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'None', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecNone_VdwCSTab_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'None', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecNone_VdwCSTab_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'None', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecNone_VdwCSTab_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'None', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecNone_VdwCSTab_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'None', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecNone_VdwCSTab_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'None', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecNone_VdwCSTab_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'None', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecNone_VdwCSTab_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'None', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecNone_VdwCSTab_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'None', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecNone_VdwCSTab_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'None', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecNone_VdwCSTab_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'None', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecNone_VdwCSTab_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'None', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecNone_VdwCSTab_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'None', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecNone_VdwCSTab_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'None', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

Initiating neighbourlist (ielec=0, ivdw=3, type=0) for Particle-Particle interactions,
with 1445 SR, 0 LR atoms.
NB kernel nb_kernel_ElecNone_VdwCSTab_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'None', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecNone_VdwCSTab_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'None', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecNone_VdwCSTab_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'None', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecNone_VdwCSTab_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'None', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecNone_VdwCSTab_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'None', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecNone_VdwCSTab_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'None', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecNone_VdwCSTab_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'None', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecNone_VdwCSTab_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'None', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecNone_VdwCSTab_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'None', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecNone_VdwCSTab_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'None', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecNone_VdwCSTab_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'None', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecNone_VdwCSTab_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'None', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecNone_VdwCSTab_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'None', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecNone_VdwCSTab_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'None', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecNone_VdwCSTab_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'None', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecNone_VdwCSTab_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'None', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecNone_VdwCSTab_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'None', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

Initiating neighbourlist (ielec=0, ivdw=3, type=0) for Particle-Particle interactions,
with 1463 SR, 0 LR atoms.
Initiating neighbourlist (ielec=0, ivdw=3, type=0) for Particle-Particle interactions,
with 1451 SR, 0 LR atoms.
Initiating neighbourlist (ielec=0, ivdw=3, type=0) for Particle-Particle interactions,
with 1463 SR, 0 LR atoms.
Initiating neighbourlist (ielec=0, ivdw=3, type=0) for Particle-Particle interactions,
with 1462 SR, 0 LR atoms.
Initiating neighbourlist (ielec=0, ivdw=3, type=0) for Particle-Particle interactions,
with 1461 SR, 0 LR atoms.
Initiating neighbourlist (ielec=0, ivdw=3, type=0) for Particle-Particle interactions,
with 1465 SR, 0 LR atoms.
Initiating neighbourlist (ielec=0, ivdw=3, type=0) for Particle-Particle interactions,
with 1466 SR, 0 LR atoms.
Initiating neighbourlist (ielec=0, ivdw=3, type=0) for Particle-Particle interactions,
with 1474 SR, 0 LR atoms.
Initiating neighbourlist (ielec=0, ivdw=3, type=0) for Particle-Particle interactions,
with 1475 SR, 0 LR atoms.
Initiating neighbourlist (ielec=0, ivdw=3, type=0) for Particle-Particle interactions,
with 1551 SR, 0 LR atoms.
Initiating neighbourlist (ielec=0, ivdw=3, type=0) for Particle-Particle interactions,
with 1455 SR, 0 LR atoms.
Initiating neighbourlist (ielec=0, ivdw=3, type=0) for Particle-Particle interactions,
with 1469 SR, 0 LR atoms.
Initiating neighbourlist (ielec=0, ivdw=3, type=0) for Particle-Particle interactions,
with 1442 SR, 0 LR atoms.
Initiating neighbourlist (ielec=0, ivdw=3, type=0) for Particle-Particle interactions,
with 1428 SR, 0 LR atoms.
NB kernel nb_kernel_ElecNone_VdwCSTab_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'None', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

Initiating neighbourlist (ielec=0, ivdw=3, type=0) for Particle-Particle interactions,
with 1741 SR, 0 LR atoms.
Initiating neighbourlist (ielec=0, ivdw=3, type=0) for Particle-Particle interactions,
with 1591 SR, 0 LR atoms.
Initiating neighbourlist (ielec=0, ivdw=3, type=0) for Particle-Particle interactions,
with 1479 SR, 0 LR atoms.
Initiating neighbourlist (ielec=0, ivdw=3, type=0) for Particle-Particle interactions,
with 1479 SR, 0 LR atoms.
Initiating neighbourlist (ielec=0, ivdw=3, type=0) for Particle-Particle interactions,
with 1561 SR, 0 LR atoms.
Initiating neighbourlist (ielec=0, ivdw=3, type=0) for Particle-Particle interactions,
with 1461 SR, 0 LR atoms.
Initiating neighbourlist (ielec=0, ivdw=3, type=0) for Particle-Particle interactions,
with 1455 SR, 0 LR atoms.
Initiating neighbourlist (ielec=0, ivdw=3, type=0) for Particle-Particle interactions,
with 1447 SR, 0 LR atoms.
Initiating neighbourlist (ielec=0, ivdw=3, type=0) for Particle-Particle interactions,
with 1493 SR, 0 LR atoms.
Initiating neighbourlist (ielec=0, ivdw=3, type=0) for Particle-Particle interactions,
with 1695 SR, 0 LR atoms.
Initiating neighbourlist (ielec=0, ivdw=3, type=0) for Particle-Particle interactions,
with 1489 SR, 0 LR atoms.
Initiating neighbourlist (ielec=0, ivdw=3, type=0) for Particle-Particle interactions,
with 1455 SR, 0 LR atoms.
Initiating neighbourlist (ielec=0, ivdw=3, type=0) for Particle-Particle interactions,
with 1502 SR, 0 LR atoms.
Initiating neighbourlist (ielec=0, ivdw=3, type=0) for Particle-Particle interactions,
with 1523 SR, 0 LR atoms.
Initiating neighbourlist (ielec=0, ivdw=3, type=0) for Particle-Particle interactions,
with 1580 SR, 0 LR atoms.
Initiating neighbourlist (ielec=0, ivdw=3, type=0) for Particle-Particle interactions,
with 1604 SR, 0 LR atoms.
Initiating neighbourlist (ielec=0, ivdw=3, type=0) for Particle-Particle interactions,
with 1471 SR, 0 LR atoms.
NB kernel nb_kernel_ElecNone_VdwCSTab_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'None', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecNone_VdwCSTab_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'None', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecNone_VdwCSTab_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'None', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecNone_VdwCSTab_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'None', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecNone_VdwCSTab_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'None', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecNone_VdwCSTab_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'None', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecNone_VdwCSTab_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'None', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecNone_VdwCSTab_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'None', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecNone_VdwCSTab_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'None', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecNone_VdwCSTab_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'None', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecNone_VdwCSTab_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'None', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecNone_VdwCSTab_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'None', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecNone_VdwCSTab_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'None', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecNone_VdwCSTab_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'None', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecNone_VdwCSTab_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'None', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecNone_VdwCSTab_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'None', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecNone_VdwCSTab_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'None', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecNone_VdwCSTab_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'None', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecNone_VdwCSTab_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'None', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecNone_VdwCSTab_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'None', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecNone_VdwCSTab_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'None', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecNone_VdwCSTab_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'None', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecNone_VdwCSTab_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'None', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecNone_VdwCSTab_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'None', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecNone_VdwCSTab_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'None', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecNone_VdwCSTab_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'None', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecNone_VdwCSTab_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'None', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecNone_VdwCSTab_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'None', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecNone_VdwCSTab_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'None', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecNone_VdwCSTab_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'None', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecNone_VdwCSTab_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'None', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecNone_VdwCSTab_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'None', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecNone_VdwCSTab_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'None', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecNone_VdwCSTab_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'None', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecNone_VdwCSTab_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'None', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecNone_VdwCSTab_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'None', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecNone_VdwCSTab_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'None', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecNone_VdwCSTab_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'None', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecNone_VdwCSTab_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'None', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecNone_VdwCSTab_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'None', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecNone_VdwCSTab_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'None', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecNone_VdwCSTab_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'None', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecNone_VdwCSTab_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'None', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecNone_VdwCSTab_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'None', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecNone_VdwCSTab_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'None', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecNone_VdwCSTab_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'None', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

Initiating neighbourlist (ielec=0, ivdw=3, type=0) for Particle-Particle interactions,
with 1445 SR, 0 LR atoms.
NB kernel nb_kernel_ElecNone_VdwCSTab_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'None', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecNone_VdwCSTab_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'None', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecNone_VdwCSTab_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'None', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecNone_VdwCSTab_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'None', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecNone_VdwCSTab_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'None', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecNone_VdwCSTab_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'None', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecNone_VdwCSTab_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'None', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecNone_VdwCSTab_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'None', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecNone_VdwCSTab_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'None', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecNone_VdwCSTab_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'None', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecNone_VdwCSTab_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'None', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecNone_VdwCSTab_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'None', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecNone_VdwCSTab_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'None', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecNone_VdwCSTab_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'None', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecNone_VdwCSTab_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'None', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecNone_VdwCSTab_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'None', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecNone_VdwCSTab_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'None', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

Initiating neighbourlist (ielec=0, ivdw=3, type=0) for Particle-Particle interactions,
with 1463 SR, 0 LR atoms.
Initiating neighbourlist (ielec=0, ivdw=3, type=0) for Particle-Particle interactions,
with 1451 SR, 0 LR atoms.
Initiating neighbourlist (ielec=0, ivdw=3, type=0) for Particle-Particle interactions,
with 1463 SR, 0 LR atoms.
Initiating neighbourlist (ielec=0, ivdw=3, type=0) for Particle-Particle interactions,
with 1462 SR, 0 LR atoms.
Initiating neighbourlist (ielec=0, ivdw=3, type=0) for Particle-Particle interactions,
with 1461 SR, 0 LR atoms.
Initiating neighbourlist (ielec=0, ivdw=3, type=0) for Particle-Particle interactions,
with 1465 SR, 0 LR atoms.
Initiating neighbourlist (ielec=0, ivdw=3, type=0) for Particle-Particle interactions,
with 1466 SR, 0 LR atoms.
Initiating neighbourlist (ielec=0, ivdw=3, type=0) for Particle-Particle interactions,
with 1474 SR, 0 LR atoms.
Initiating neighbourlist (ielec=0, ivdw=3, type=0) for Particle-Particle interactions,
with 1475 SR, 0 LR atoms.
Initiating neighbourlist (ielec=0, ivdw=3, type=0) for Particle-Particle interactions,
with 1551 SR, 0 LR atoms.
Initiating neighbourlist (ielec=0, ivdw=3, type=0) for Particle-Particle interactions,
with 1455 SR, 0 LR atoms.
Initiating neighbourlist (ielec=0, ivdw=3, type=0) for Particle-Particle interactions,
with 1469 SR, 0 LR atoms.
Initiating neighbourlist (ielec=0, ivdw=3, type=0) for Particle-Particle interactions,
with 1442 SR, 0 LR atoms.
Initiating neighbourlist (ielec=0, ivdw=3, type=0) for Particle-Particle interactions,
with 1428 SR, 0 LR atoms.
NB kernel nb_kernel_ElecCSTab_VdwNone_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

Initiating neighbourlist (ielec=0, ivdw=3, type=0) for Particle-Particle interactions,
with 1741 SR, 0 LR atoms.
Initiating neighbourlist (ielec=0, ivdw=3, type=0) for Particle-Particle interactions,
with 1591 SR, 0 LR atoms.
Initiating neighbourlist (ielec=0, ivdw=3, type=0) for Particle-Particle interactions,
with 1479 SR, 0 LR atoms.
Initiating neighbourlist (ielec=0, ivdw=3, type=0) for Particle-Particle interactions,
with 1479 SR, 0 LR atoms.
Initiating neighbourlist (ielec=0, ivdw=3, type=0) for Particle-Particle interactions,
with 1561 SR, 0 LR atoms.
Initiating neighbourlist (ielec=0, ivdw=3, type=0) for Particle-Particle interactions,
with 1461 SR, 0 LR atoms.
Initiating neighbourlist (ielec=0, ivdw=3, type=0) for Particle-Particle interactions,
with 1455 SR, 0 LR atoms.
Initiating neighbourlist (ielec=0, ivdw=3, type=0) for Particle-Particle interactions,
with 1447 SR, 0 LR atoms.
Initiating neighbourlist (ielec=0, ivdw=3, type=0) for Particle-Particle interactions,
with 1493 SR, 0 LR atoms.
Initiating neighbourlist (ielec=0, ivdw=3, type=0) for Particle-Particle interactions,
with 1695 SR, 0 LR atoms.
Initiating neighbourlist (ielec=0, ivdw=3, type=0) for Particle-Particle interactions,
with 1489 SR, 0 LR atoms.
Initiating neighbourlist (ielec=0, ivdw=3, type=0) for Particle-Particle interactions,
with 1455 SR, 0 LR atoms.
Initiating neighbourlist (ielec=0, ivdw=3, type=0) for Particle-Particle interactions,
with 1502 SR, 0 LR atoms.
Initiating neighbourlist (ielec=0, ivdw=3, type=0) for Particle-Particle interactions,
with 1523 SR, 0 LR atoms.
Initiating neighbourlist (ielec=0, ivdw=3, type=0) for Particle-Particle interactions,
with 1580 SR, 0 LR atoms.
Initiating neighbourlist (ielec=0, ivdw=3, type=0) for Particle-Particle interactions,
with 1604 SR, 0 LR atoms.
Initiating neighbourlist (ielec=0, ivdw=3, type=0) for Particle-Particle interactions,
with 1471 SR, 0 LR atoms.
NB kernel nb_kernel_ElecCSTab_VdwNone_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

Initiating neighbourlist (ielec=3, ivdw=0, type=0) for Particle-Particle interactions,
with 1445 SR, 0 LR atoms.
NB kernel nb_kernel_ElecCSTab_VdwNone_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

Initiating neighbourlist (ielec=3, ivdw=0, type=0) for Particle-Particle interactions,
with 1463 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=0, type=0) for Particle-Particle interactions,
with 1451 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=0, type=0) for Particle-Particle interactions,
with 1463 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=0, type=0) for Particle-Particle interactions,
with 1462 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=0, type=0) for Particle-Particle interactions,
with 1461 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=0, type=0) for Particle-Particle interactions,
with 1465 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=0, type=0) for Particle-Particle interactions,
with 1466 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=0, type=0) for Particle-Particle interactions,
with 1474 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=0, type=0) for Particle-Particle interactions,
with 1475 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=0, type=0) for Particle-Particle interactions,
with 1551 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=0, type=0) for Particle-Particle interactions,
with 1455 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=0, type=0) for Particle-Particle interactions,
with 1469 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=0, type=0) for Particle-Particle interactions,
with 1442 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=0, type=0) for Particle-Particle interactions,
with 1428 SR, 0 LR atoms.
NB kernel nb_kernel_ElecCSTab_VdwNone_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

Initiating neighbourlist (ielec=3, ivdw=0, type=0) for Particle-Particle interactions,
with 1741 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=0, type=0) for Particle-Particle interactions,
with 1591 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=0, type=0) for Particle-Particle interactions,
with 1479 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=0, type=0) for Particle-Particle interactions,
with 1479 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=0, type=0) for Particle-Particle interactions,
with 1561 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=0, type=0) for Particle-Particle interactions,
with 1461 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=0, type=0) for Particle-Particle interactions,
with 1455 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=0, type=0) for Particle-Particle interactions,
with 1447 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=0, type=0) for Particle-Particle interactions,
with 1493 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=0, type=0) for Particle-Particle interactions,
with 1695 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=0, type=0) for Particle-Particle interactions,
with 1489 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=0, type=0) for Particle-Particle interactions,
with 1455 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=0, type=0) for Particle-Particle interactions,
with 1502 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=0, type=0) for Particle-Particle interactions,
with 1523 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=0, type=0) for Particle-Particle interactions,
with 1580 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=0, type=0) for Particle-Particle interactions,
with 1604 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=0, type=0) for Particle-Particle interactions,
with 1471 SR, 0 LR atoms.
NB kernel nb_kernel_ElecCSTab_VdwNone_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomP1P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

Initiating neighbourlist (ielec=3, ivdw=0, type=0) for Particle-Particle interactions,
with 1445 SR, 0 LR atoms.
NB kernel nb_kernel_ElecCSTab_VdwNone_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomP1P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Particle-Particle', Other: '', Calc: 'Force'

Initiating neighbourlist (ielec=3, ivdw=0, type=0) for Particle-Particle interactions,
with 1463 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=0, type=0) for Particle-Particle interactions,
with 1451 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=0, type=0) for Particle-Particle interactions,
with 1463 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=0, type=0) for Particle-Particle interactions,
with 1462 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=0, type=0) for Particle-Particle interactions,
with 1461 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=0, type=0) for Particle-Particle interactions,
with 1465 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=0, type=0) for Particle-Particle interactions,
with 1466 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=0, type=0) for Particle-Particle interactions,
with 1474 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=0, type=0) for Particle-Particle interactions,
with 1475 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=0, type=0) for Particle-Particle interactions,
with 1551 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=0, type=0) for Particle-Particle interactions,
with 1455 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=0, type=0) for Particle-Particle interactions,
with 1469 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=0, type=0) for Particle-Particle interactions,
with 1442 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=0, type=0) for Particle-Particle interactions,
with 1428 SR, 0 LR atoms.
NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'PotentialAndForce'

Initiating neighbourlist (ielec=3, ivdw=0, type=0) for Particle-Particle interactions,
with 1741 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=0, type=0) for Particle-Particle interactions,
with 1591 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=0, type=0) for Particle-Particle interactions,
with 1479 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=0, type=0) for Particle-Particle interactions,
with 1479 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=0, type=0) for Particle-Particle interactions,
with 1561 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=0, type=0) for Particle-Particle interactions,
with 1461 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=0, type=0) for Particle-Particle interactions,
with 1455 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=0, type=0) for Particle-Particle interactions,
with 1447 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=0, type=0) for Particle-Particle interactions,
with 1493 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=0, type=0) for Particle-Particle interactions,
with 1695 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=0, type=0) for Particle-Particle interactions,
with 1489 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=0, type=0) for Particle-Particle interactions,
with 1455 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=0, type=0) for Particle-Particle interactions,
with 1502 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=0, type=0) for Particle-Particle interactions,
with 1523 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=0, type=0) for Particle-Particle interactions,
with 1580 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=0, type=0) for Particle-Particle interactions,
with 1604 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=0, type=0) for Particle-Particle interactions,
with 1471 SR, 0 LR atoms.
NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'Force'

Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Water3-Particle interactions,
with 0 SR, 0 LR atoms.
NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'Force'

Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Water3-Particle interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Water3-Particle interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Water3-Particle interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Water3-Particle interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Water3-Particle interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Water3-Particle interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Water3-Particle interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Water3-Particle interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Water3-Particle interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Water3-Particle interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Water3-Particle interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Water3-Particle interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Water3-Particle interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Water3-Particle interactions,
with 0 SR, 0 LR atoms.
NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'PotentialAndForce'

Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Water3-Particle interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Water3-Particle interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Water3-Particle interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Water3-Particle interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Water3-Particle interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Water3-Particle interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Water3-Particle interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Water3-Particle interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Water3-Particle interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Water3-Particle interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Water3-Particle interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Water3-Particle interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Water3-Particle interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Water3-Particle interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Water3-Particle interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Water3-Particle interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Water3-Particle interactions,
with 0 SR, 0 LR atoms.
NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'Force'

Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Water3-Particle interactions,
with 0 SR, 0 LR atoms.
NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'Force'

Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Water3-Particle interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Water3-Particle interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Water3-Particle interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Water3-Particle interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Water3-Particle interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Water3-Particle interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Water3-Particle interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Water3-Particle interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Water3-Particle interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Water3-Particle interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Water3-Particle interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Water3-Particle interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Water3-Particle interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Water3-Particle interactions,
with 0 SR, 0 LR atoms.
NB kernel nb_kernel_ElecCSTab_VdwNone_GeomW3P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'PotentialAndForce'

Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Water3-Particle interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Water3-Particle interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Water3-Particle interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Water3-Particle interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Water3-Particle interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Water3-Particle interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Water3-Particle interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Water3-Particle interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Water3-Particle interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Water3-Particle interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Water3-Particle interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Water3-Particle interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Water3-Particle interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Water3-Particle interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Water3-Particle interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Water3-Particle interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Water3-Particle interactions,
with 0 SR, 0 LR atoms.
NB kernel nb_kernel_ElecCSTab_VdwNone_GeomW3P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomW3P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomW3P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomW3P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomW3P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomW3P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomW3P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomW3P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomW3P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomW3P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomW3P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomW3P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomW3P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomW3P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomW3P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomW3P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomW3P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomW3P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomW3P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomW3P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomW3P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomW3P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomW3P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomW3P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomW3P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomW3P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomW3P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomW3P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomW3P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomW3P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomW3P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomW3P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomW3P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomW3P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomW3P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomW3P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomW3P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomW3P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomW3P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomW3P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomW3P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomW3P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomW3P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomW3P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomW3P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomW3P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'Force'

Initiating neighbourlist (ielec=3, ivdw=0, type=0) for Water3-Particle interactions,
with 0 SR, 0 LR atoms.
NB kernel nb_kernel_ElecCSTab_VdwNone_GeomW3P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomW3P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomW3P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomW3P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomW3P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomW3P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomW3P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomW3P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomW3P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomW3P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomW3P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomW3P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomW3P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomW3P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomW3P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomW3P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomW3P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'Force'

Initiating neighbourlist (ielec=3, ivdw=0, type=0) for Water3-Particle interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=0, type=0) for Water3-Particle interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=0, type=0) for Water3-Particle interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=0, type=0) for Water3-Particle interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=0, type=0) for Water3-Particle interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=0, type=0) for Water3-Particle interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=0, type=0) for Water3-Particle interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=0, type=0) for Water3-Particle interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=0, type=0) for Water3-Particle interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=0, type=0) for Water3-Particle interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=0, type=0) for Water3-Particle interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=0, type=0) for Water3-Particle interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=0, type=0) for Water3-Particle interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=0, type=0) for Water3-Particle interactions,
with 0 SR, 0 LR atoms.
NB kernel nb_kernel_ElecCSTab_VdwNone_GeomW3P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'PotentialAndForce'

Initiating neighbourlist (ielec=3, ivdw=0, type=0) for Water3-Particle interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=0, type=0) for Water3-Particle interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=0, type=0) for Water3-Particle interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=0, type=0) for Water3-Particle interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=0, type=0) for Water3-Particle interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=0, type=0) for Water3-Particle interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=0, type=0) for Water3-Particle interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=0, type=0) for Water3-Particle interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=0, type=0) for Water3-Particle interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=0, type=0) for Water3-Particle interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=0, type=0) for Water3-Particle interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=0, type=0) for Water3-Particle interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=0, type=0) for Water3-Particle interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=0, type=0) for Water3-Particle interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=0, type=0) for Water3-Particle interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=0, type=0) for Water3-Particle interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=0, type=0) for Water3-Particle interactions,
with 0 SR, 0 LR atoms.
NB kernel nb_kernel_ElecCSTab_VdwNone_GeomW3P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomW3P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomW3P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomW3P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomW3P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomW3P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomW3P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomW3P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomW3P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomW3P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomW3P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomW3P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomW3P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomW3P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomW3P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomW3P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomW3P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomW3P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomW3P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomW3P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomW3P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomW3P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomW3P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomW3P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomW3P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomW3P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomW3P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomW3P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomW3P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomW3P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomW3P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomW3P1_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomW3P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomW3P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomW3P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomW3P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomW3P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomW3P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomW3P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomW3P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomW3P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomW3P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomW3P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomW3P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomW3P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomW3P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'Force'

Initiating neighbourlist (ielec=3, ivdw=0, type=0) for Water3-Particle interactions,
with 0 SR, 0 LR atoms.
NB kernel nb_kernel_ElecCSTab_VdwNone_GeomW3P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomW3P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomW3P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomW3P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomW3P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomW3P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomW3P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomW3P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomW3P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomW3P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomW3P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomW3P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomW3P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomW3P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomW3P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomW3P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomW3P1_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Water3-Particle', Other: '', Calc: 'Force'

Initiating neighbourlist (ielec=3, ivdw=0, type=0) for Water3-Particle interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=0, type=0) for Water3-Particle interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=0, type=0) for Water3-Particle interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=0, type=0) for Water3-Particle interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=0, type=0) for Water3-Particle interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=0, type=0) for Water3-Particle interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=0, type=0) for Water3-Particle interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=0, type=0) for Water3-Particle interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=0, type=0) for Water3-Particle interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=0, type=0) for Water3-Particle interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=0, type=0) for Water3-Particle interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=0, type=0) for Water3-Particle interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=0, type=0) for Water3-Particle interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=0, type=0) for Water3-Particle interactions,
with 0 SR, 0 LR atoms.
NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3W3_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Water3', Other: '', Calc: 'PotentialAndForce'

Initiating neighbourlist (ielec=3, ivdw=0, type=0) for Water3-Particle interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=0, type=0) for Water3-Particle interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=0, type=0) for Water3-Particle interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=0, type=0) for Water3-Particle interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=0, type=0) for Water3-Particle interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=0, type=0) for Water3-Particle interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=0, type=0) for Water3-Particle interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=0, type=0) for Water3-Particle interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=0, type=0) for Water3-Particle interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=0, type=0) for Water3-Particle interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=0, type=0) for Water3-Particle interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=0, type=0) for Water3-Particle interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=0, type=0) for Water3-Particle interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=0, type=0) for Water3-Particle interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=0, type=0) for Water3-Particle interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=0, type=0) for Water3-Particle interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=0, type=0) for Water3-Particle interactions,
with 0 SR, 0 LR atoms.
NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3W3_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Water3', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3W3_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Water3', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3W3_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Water3', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3W3_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Water3', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3W3_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Water3', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3W3_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Water3', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3W3_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Water3', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3W3_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Water3', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3W3_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Water3', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3W3_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Water3', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3W3_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Water3', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3W3_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Water3', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3W3_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Water3', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3W3_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Water3', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3W3_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Water3', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3W3_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Water3', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3W3_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Water3', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3W3_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Water3', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3W3_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Water3', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3W3_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Water3', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3W3_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Water3', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3W3_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Water3', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3W3_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Water3', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3W3_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Water3', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3W3_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Water3', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3W3_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Water3', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3W3_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Water3', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3W3_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Water3', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3W3_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Water3', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3W3_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Water3', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3W3_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Water3', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3W3_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Water3', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3W3_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Water3', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3W3_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Water3', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3W3_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Water3', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3W3_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Water3', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3W3_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Water3', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3W3_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Water3', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3W3_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Water3', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3W3_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Water3', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3W3_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Water3', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3W3_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Water3', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3W3_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Water3', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3W3_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Water3', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3W3_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Water3', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3W3_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Water3', Other: '', Calc: 'Force'

Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Water3-Water3 interactions,
with 0 SR, 0 LR atoms.
NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3W3_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Water3', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3W3_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Water3', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3W3_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Water3', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3W3_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Water3', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3W3_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Water3', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3W3_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Water3', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3W3_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Water3', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3W3_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Water3', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3W3_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Water3', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3W3_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Water3', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3W3_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Water3', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3W3_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Water3', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3W3_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Water3', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3W3_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Water3', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3W3_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Water3', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3W3_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Water3', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3W3_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Water3', Other: '', Calc: 'Force'

Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Water3-Water3 interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Water3-Water3 interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Water3-Water3 interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Water3-Water3 interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Water3-Water3 interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Water3-Water3 interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Water3-Water3 interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Water3-Water3 interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Water3-Water3 interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Water3-Water3 interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Water3-Water3 interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Water3-Water3 interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Water3-Water3 interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Water3-Water3 interactions,
with 0 SR, 0 LR atoms.
NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3W3_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Water3', Other: '', Calc: 'PotentialAndForce'

Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Water3-Water3 interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Water3-Water3 interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Water3-Water3 interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Water3-Water3 interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Water3-Water3 interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Water3-Water3 interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Water3-Water3 interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Water3-Water3 interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Water3-Water3 interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Water3-Water3 interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Water3-Water3 interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Water3-Water3 interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Water3-Water3 interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Water3-Water3 interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Water3-Water3 interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Water3-Water3 interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Water3-Water3 interactions,
with 0 SR, 0 LR atoms.
NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3W3_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Water3', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3W3_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Water3', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3W3_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Water3', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3W3_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Water3', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3W3_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Water3', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3W3_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Water3', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3W3_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Water3', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3W3_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Water3', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3W3_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Water3', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3W3_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Water3', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3W3_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Water3', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3W3_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Water3', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3W3_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Water3', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3W3_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Water3', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3W3_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Water3', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3W3_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Water3', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3W3_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Water3', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3W3_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Water3', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3W3_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Water3', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3W3_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Water3', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3W3_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Water3', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3W3_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Water3', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3W3_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Water3', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3W3_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Water3', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3W3_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Water3', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3W3_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Water3', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3W3_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Water3', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3W3_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Water3', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3W3_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Water3', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3W3_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Water3', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3W3_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Water3', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3W3_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Water3', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3W3_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Water3', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3W3_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Water3', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3W3_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Water3', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3W3_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Water3', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3W3_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Water3', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3W3_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Water3', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3W3_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Water3', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3W3_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Water3', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3W3_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Water3', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3W3_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Water3', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3W3_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Water3', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3W3_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Water3', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3W3_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Water3', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3W3_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Water3', Other: '', Calc: 'Force'

Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Water3-Water3 interactions,
with 0 SR, 0 LR atoms.
NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3W3_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Water3', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3W3_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Water3', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3W3_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Water3', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3W3_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Water3', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3W3_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Water3', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3W3_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Water3', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3W3_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Water3', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3W3_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Water3', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3W3_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Water3', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3W3_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Water3', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3W3_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Water3', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3W3_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Water3', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3W3_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Water3', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3W3_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Water3', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3W3_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Water3', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3W3_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Water3', Other: '', Calc: 'Force'

NB kernel nb_kernel_ElecCSTab_VdwCSTab_GeomW3W3_F_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'Cubic-Spline-Table', Modifier: 'None'
    Geom: 'Water3-Water3', Other: '', Calc: 'Force'

Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Water3-Water3 interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Water3-Water3 interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Water3-Water3 interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Water3-Water3 interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Water3-Water3 interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Water3-Water3 interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Water3-Water3 interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Water3-Water3 interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Water3-Water3 interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Water3-Water3 interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Water3-Water3 interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Water3-Water3 interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Water3-Water3 interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Water3-Water3 interactions,
with 0 SR, 0 LR atoms.
NB kernel nb_kernel_ElecCSTab_VdwNone_GeomW3W3_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Water3-Water3', Other: '', Calc: 'PotentialAndForce'

Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Water3-Water3 interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Water3-Water3 interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Water3-Water3 interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Water3-Water3 interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Water3-Water3 interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Water3-Water3 interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Water3-Water3 interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Water3-Water3 interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Water3-Water3 interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Water3-Water3 interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Water3-Water3 interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Water3-Water3 interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Water3-Water3 interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Water3-Water3 interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Water3-Water3 interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Water3-Water3 interactions,
with 0 SR, 0 LR atoms.
Initiating neighbourlist (ielec=3, ivdw=3, type=0) for Water3-Water3 interactions,
with 0 SR, 0 LR atoms.
NB kernel nb_kernel_ElecCSTab_VdwNone_GeomW3W3_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Water3-Water3', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomW3W3_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Water3-Water3', Other: '', Calc: 'PotentialAndForce'

NB kernel nb_kernel_ElecCSTab_VdwNone_GeomW3W3_VF_avx_256_single() with architecture 'avx_256_single' used for neighborlist with
    Elec: 'Cubic-Spline-Table', Modifier: 'None'
    Vdw:  'None', Modifier: 'None'
    Geom: 'Water3-Water3', Other: '', Calc: 'PotentialAndForce'

Initiating neighbourlist (ielec=3, ivdw=0, type=0) for Water3-Water3 interactions,
with 0 SR, 0 LR atoms.

Filling grid from 1463 to 3070
Filling grid from 1451 to 3028
F
CG0[0]=0, CG1[0]=3070
calc_bor: cg0=0, cg1=3106, ncg=3106
CG0[0]=0, CG1[0]=3028

nsearch = 241036
Box (3x3):
   Box[    0]={ 1.97002e+01,  0.00000e+00,  0.00000e+00}
   Box[    1]={ 0.00000e+00,  1.97002e+01,  0.00000e+00}
   Box[    2]={ 9.85009e+00,  9.85009e+00,  1.39301e+01}
max cutoff 9.850
  tricvec  1 =  0  0 -1  15.57  6.97  -9.85 -9.85 -13.93   9.85  9.85  6.97
  tricvec  2 =  1  0 -1  15.57  6.97   9.85 -9.85 -13.93  -9.85  9.85  6.97
  tricvec  3 =  0  1 -1  15.57  6.97  -9.85  9.85 -13.93   9.85 -9.85  6.97
nsearch = 240199
  tricvec  4 =  1  1 -1  15.57  6.97   9.85  9.85 -13.93  -9.85 -9.85  6.97
Box (3x3):
nsearch = 244344
nsearch = 251038
  tricvec  5 =  0  0  1  15.57  6.97   9.85  9.85 13.93  -9.85 -9.85 -6.97
 Box (3x3):
Box (3x3):
nsearch = 259577
  tricvec  6 = -1  0  1  15.57  6.97  -9.85  9.85 13.93   9.85 -9.85 -6.97
nsearch = 243784
   Box (3x3):
nsearch = 245339
  tricvec  7 =  0 -1  1  15.57  6.97   9.85 -9.85 13.93  -9.85  9.85 -6.97
 Box (3x3):
   Box (3x3):
nsearch = 245156
  tricvec  8 = -1 -1  1  15.57  6.97  -9.85 -9.85 13.93   9.85  9.85 -6.97
Box[    0]={  nsearch = 246128
   Box (3x3):
 1.97002e+01nsearch = 257690
 Box[    0]={Box[    0]={Box (3x3):
   ,  Box (3x3):
 1.97002e+01 1.97002e+01 Box[    0]={   0.00000e+00Box[    0]={ , ,   1.97002e+01Box[    0]={ ,  1.97002e+01  0.00000e+00 0.00000e+00 nsearch = 249273
,  1.97002e+01Box[    0]={ 0.00000e+00nsearch = 245961
,  , , Box[    0]={ 0.00000e+00Box (3x3):
,  1.97002e+01}
 0.00000e+00Box (3x3):
Box[    0]={ 0.00000e+00 0.00000e+00 1.97002e+01,   0.00000e+00, nsearch = 242994
 ,   1.97002e+01}
nsearch = 244064
}
,  0.00000e+00nsearch = 251265
 ,  0.00000e+00 Box (3x3):
 0.00000e+00nsearch = 291081
 ,  nsearch = 252455
 Box (3x3):
 0.00000e+00}
 Box (3x3):
 0.00000e+00,   }
Box (3x3):
  0.00000e+00nsearch = 245303
  Box (3x3):
 ,  Box[    0]={ }
 0.00000e+00Box[    1]={   Box[    0]={,  Box (3x3):
    0.00000e+00  1.97002e+01  }
 0.00000e+00   nsearch = 267787
 1.97002e+01 0.00000e+00Box[    1]={ nsearch = 250638
Box[    1]={  nsearch = 254407
}
 ,   nsearch = 260640
 nsearch = 244590
, Box[    0]={  Box (3x3):
, }
 0.00000e+00  0.00000e+00 Box[    0]={Box (3x3):
Box (3x3):
 Box[    1]={ 0.00000e+00Box[    0]={  nsearch = 247957
Box (3x3):
 1.97002e+01 1.97002e+01Box (3x3):
Box[    1]={Box[    0]={  0.00000e+00 ,  , Box[    0]={ 1.97002e+01nsearch = 264255
    0.00000e+00,  1.97002e+01Box[    1]={ Box (3x3):
 , ,   0.00000e+00 1.97002e+01 ,   1.97002e+01Box[    0]={nsearch = 251284
 1.97002e+01 1.97002e+01,  nsearch = 306541
  ,  0.00000e+00,  0.00000e+00Box[    1]={ Box (3x3):
  0.00000e+00 0.00000e+00 , ,   0.00000e+00nsearch = 281555
 ,  1.97002e+01Box (3x3):
, ,  0.00000e+00  Box (3x3):
Box[    1]={ 1.97002e+01}
nsearch = 289052
 0.00000e+00,  0.00000e+00   }
,   1.97002e+01 0.00000e+00Box[    0]={}
Box[    1]={Box (3x3):
 0.00000e+00, nsearch = 327669
  0.00000e+00 0.00000e+00, Box[    0]={Box[    0]={  0.00000e+00,  Box (3x3):
,  1.97002e+01nsearch = 286622
,   Box[    0]={  0.00000e+00Box[    0]={, ,  1.97002e+01  0.00000e+00 }
 0.00000e+00 nsearch = 326577
Box (3x3):
}
,  0.00000e+00 1.97002e+01 1.97002e+01 ,  0.00000e+00   0.00000e+00,  1.97002e+01Box[    0]={Box (3x3):
  1.97002e+01 }
 1.97002e+01 0.00000e+00 0.00000e+00,  ,   ,  Box (3x3):
   0.00000e+00}
, ,   1.97002e+01}
  }
 0.00000e+00,  1.97002e+01 Box[    0]={,   , }
}
 0.00000e+00  1.97002e+01   0.00000e+00Box[    0]={   }
  0.00000e+00 0.00000e+00Box[    0]={,  Box[    1]={  }
 0.00000e+00,   1.97002e+01 0.00000e+00Box[    2]={  0.00000e+00  , Box[    1]={, Box[    0]={ }
 1.97002e+01     , ,  1.97002e+01 0.00000e+00  0.00000e+00Box[    0]={  }
 0.00000e+00 , ,  9.85009e+00 ,    0.00000e+00 0.00000e+00 0.00000e+00 1.97002e+01Box[    2]={ ,  Box[    0]={Box[    2]={   0.00000e+00 0.00000e+00, }
 ,  1.97002e+01   , Box[    0]={ 0.00000e+00 0.00000e+00, Box[    1]={ 0.00000e+00  }
, }
,  9.85009e+00  0.00000e+00Box[    0]={ 1.97002e+01 9.85009e+00 Box[    1]={}
}
 0.00000e+00 Box[    2]={ 1.97002e+01, Box[    1]={   0.00000e+00 1.97002e+01, }
 9.85009e+00 0.00000e+00}
Box[    2]={Box[    1]={  1.97002e+01  0.00000e+00,  ,  1.97002e+01, , Box[    1]={ 0.00000e+00  ,   9.85009e+00,  0.00000e+00 0.00000e+00Box[    2]={ }
,  0.00000e+00 , ,   9.85009e+00 0.00000e+00 ,  ,  9.85009e+00Box[    1]={ 0.00000e+00,  0.00000e+00 9.85009e+00 0.00000e+00,    0.00000e+00 ,  0.00000e+00, ,  9.85009e+00Box[    2]={  0.00000e+00}
  1.39301e+01 1.97002e+01 , ,   0.00000e+00  0.00000e+00,  0.00000e+00}
 0.00000e+00, , ,  1.97002e+01  }
Box[    2]={ 9.85009e+00}
 0.00000e+00 1.97002e+01,  9.85009e+00 ,   }
,   9.85009e+00 1.97002e+01Box[    1]={}
Box[    2]={}
 1.39301e+01,  ,  0.00000e+00 1.39301e+01 1.97002e+01, Box[    1]={Box[    1]={  9.85009e+00,  }
,  9.85009e+00,   0.00000e+00 Box[    1]={max cutoff 9.850
 0.00000e+00Box[    1]={, ,  0.00000e+00  9.85009e+00 }
 1.97002e+01  0.00000e+00}
}
,  0.00000e+00 0.00000e+00 0.00000e+00 ,  1.39301e+01   0.00000e+00,  9.85009e+00Box[    1]={}
  0.00000e+00  tricvec  1 =  0  0 -1  15.57  6.97  -9.85 -9.85 -13.93   9.85  9.85  6.97
}
 0.00000e+00 1.39301e+01 0.00000e+00,  ,  max cutoff 9.850
,  }
 max cutoff 9.850
 0.00000e+00}
, ,   9.85009e+00}
  }
 1.39301e+01,  0.00000e+00 Box[    1]={,   tricvec  2 =  1  0 -1  15.57  6.97   9.85 -9.85 -13.93  -9.85  9.85  6.97
 , }
}
 1.97002e+01  9.85009e+00   tricvec  1 =  0  0 -1  15.57  6.97  -9.85 -9.85 -13.93   9.85  9.85  6.97
 0.00000e+00Box[    1]={    tricvec  1 =  0  0 -1  15.57  6.97  -9.85 -9.85 -13.93   9.85  9.85  6.97
}
  1.97002e+01 1.97002e+01Box[    1]={, max cutoff 9.850
Box[    2]={  }
 1.39301e+01,   0.00000e+00 1.97002e+01  tricvec  3 =  0  1 -1  15.57  6.97  -9.85  9.85 -13.93   9.85 -9.85  6.97
  1.97002e+01max cutoff 9.850
 , Box[    2]={, Box[    1]={  tricvec  2 =  1  0 -1  15.57  6.97   9.85 -9.85 -13.93  -9.85  9.85  6.97
}
 0.00000e+00    tricvec  2 =  1  0 -1  15.57  6.97   9.85 -9.85 -13.93  -9.85  9.85  6.97
  , ,  0.00000e+00 1.39301e+01  tricvec  1 =  0  0 -1  15.57  6.97  -9.85 -9.85 -13.93   9.85  9.85  6.97
 9.85009e+00Box[    1]={ max cutoff 9.850
}
 1.97002e+01 , ,   tricvec  4 =  1  1 -1  15.57  6.97   9.85  9.85 -13.93  -9.85 -9.85  6.97
 ,   tricvec  1 =  0  0 -1  15.57  6.97  -9.85 -9.85 -13.93   9.85  9.85  6.97
  0.00000e+00 9.85009e+00 1.39301e+01 0.00000e+00  tricvec  3 =  0  1 -1  15.57  6.97  -9.85  9.85 -13.93   9.85 -9.85  6.97
 ,  Box[    1]={  tricvec  3 =  0  1 -1  15.57  6.97  -9.85  9.85 -13.93   9.85 -9.85  6.97
   0.00000e+00 0.00000e+00, }
  tricvec  2 =  1  0 -1  15.57  6.97   9.85 -9.85 -13.93  -9.85  9.85  6.97
,  0.00000e+00   tricvec  1 =  0  0 -1  15.57  6.97  -9.85 -9.85 -13.93   9.85  9.85  6.97
max cutoff 9.850
, Box[    1]={ 1.97002e+01 0.00000e+00  tricvec  5 =  0  0  1  15.57  6.97   9.85  9.85 13.93  -9.85 -9.85 -6.97
Box[    2]={ 0.00000e+00  tricvec  2 =  1  0 -1  15.57  6.97   9.85 -9.85 -13.93  -9.85  9.85  6.97
 }
, }
,   tricvec  4 =  1  1 -1  15.57  6.97   9.85  9.85 -13.93  -9.85 -9.85  6.97
  1.97002e+01Box[    1]={ 0.00000e+00  tricvec  4 =  1  1 -1  15.57  6.97   9.85  9.85 -13.93  -9.85 -9.85  6.97
 Box[    2]={}
}
 1.97002e+01max cutoff 9.850
  tricvec  3 =  0  1 -1  15.57  6.97  -9.85  9.85 -13.93   9.85 -9.85  6.97
 9.85009e+00, Box[    2]={  tricvec  2 =  1  0 -1  15.57  6.97   9.85 -9.85 -13.93  -9.85  9.85  6.97
  tricvec  1 =  0  0 -1  15.57  6.97  -9.85 -9.85 -13.93   9.85  9.85  6.97
 0.00000e+00 0.00000e+00, }
  tricvec  6 = -1  0  1  15.57  6.97  -9.85  9.85 13.93   9.85 -9.85 -6.97
 9.85009e+00}
  tricvec  3 =  0  1 -1  15.57  6.97  -9.85  9.85 -13.93   9.85 -9.85  6.97
Box[    2]={  9.85009e+00max cutoff 9.850
 1.97002e+01  tricvec  5 =  0  0  1  15.57  6.97   9.85  9.85 13.93  -9.85 -9.85 -6.97
 ,  0.00000e+00,   tricvec  5 =  0  0  1  15.57  6.97   9.85  9.85 13.93  -9.85 -9.85 -6.97
Box[    2]={ 9.85009e+00  ,   tricvec  1 =  0  0 -1  15.57  6.97  -9.85 -9.85 -13.93   9.85  9.85  6.97
  tricvec  4 =  1  1 -1  15.57  6.97   9.85  9.85 -13.93  -9.85 -9.85  6.97
,  1.97002e+01 9.85009e+00  tricvec  3 =  0  1 -1  15.57  6.97  -9.85  9.85 -13.93   9.85 -9.85  6.97
  tricvec  2 =  1  0 -1  15.57  6.97   9.85 -9.85 -13.93  -9.85  9.85  6.97
}
,  0.00000e+00   tricvec  7 =  0 -1  1  15.57  6.97   9.85 -9.85 13.93  -9.85  9.85 -6.97
,    tricvec  4 =  1  1 -1  15.57  6.97   9.85  9.85 -13.93  -9.85 -9.85  6.97
 9.85009e+00 ,   tricvec  1 =  0  0 -1  15.57  6.97  -9.85 -9.85 -13.93   9.85  9.85  6.97
,   tricvec  6 = -1  0  1  15.57  6.97  -9.85  9.85 13.93   9.85 -9.85 -6.97
Box[    2]={ 0.00000e+00,  1.97002e+01  tricvec  6 = -1  0  1  15.57  6.97  -9.85  9.85 13.93   9.85 -9.85 -6.97
 9.85009e+00,    0.00000e+00  tricvec  2 =  1  0 -1  15.57  6.97   9.85 -9.85 -13.93  -9.85  9.85  6.97
  tricvec  5 =  0  0  1  15.57  6.97   9.85  9.85 13.93  -9.85 -9.85 -6.97
 1.39301e+01, ,   tricvec  4 =  1  1 -1  15.57  6.97   9.85  9.85 -13.93  -9.85 -9.85  6.97
  tricvec  3 =  0  1 -1  15.57  6.97  -9.85  9.85 -13.93   9.85 -9.85  6.97
  1.97002e+01}
   tricvec  8 = -1 -1  1  15.57  6.97  -9.85 -9.85 13.93   9.85  9.85 -6.97
 9.85009e+00   tricvec  5 =  0  0  1  15.57  6.97   9.85  9.85 13.93  -9.85 -9.85 -6.97
,   1.39301e+01  tricvec  2 =  1  0 -1  15.57  6.97   9.85 -9.85 -13.93  -9.85  9.85  6.97
 0.00000e+00  tricvec  7 =  0 -1  1  15.57  6.97   9.85 -9.85 13.93  -9.85  9.85 -6.97
 9.85009e+00}
 1.97002e+01,   tricvec  7 =  0 -1  1  15.57  6.97   9.85 -9.85 13.93  -9.85  9.85 -6.97
,  9.85009e+00  }
  tricvec  3 =  0  1 -1  15.57  6.97  -9.85  9.85 -13.93   9.85 -9.85  6.97
  tricvec  6 = -1  0  1  15.57  6.97  -9.85  9.85 13.93   9.85 -9.85 -6.97
}
 0.00000e+00 9.85009e+00  tricvec  5 =  0  0  1  15.57  6.97   9.85  9.85 13.93  -9.85 -9.85 -6.97
  tricvec  4 =  1  1 -1  15.57  6.97   9.85  9.85 -13.93  -9.85 -9.85  6.97
 ,   ,    tricvec  6 = -1  0  1  15.57  6.97  -9.85  9.85 13.93   9.85 -9.85 -6.97
 9.85009e+00Box[    2]={}
  tricvec  3 =  0  1 -1  15.57  6.97  -9.85  9.85 -13.93   9.85 -9.85  6.97
}
  tricvec  8 = -1 -1  1  15.57  6.97  -9.85 -9.85 13.93   9.85  9.85 -6.97
,  ,  0.00000e+00  tricvec  8 = -1 -1  1  15.57  6.97  -9.85 -9.85 13.93   9.85  9.85 -6.97
 9.85009e+00, Box[    2]={Box[    2]={   tricvec  4 =  1  1 -1  15.57  6.97   9.85  9.85 -13.93  -9.85 -9.85  6.97
  tricvec  7 =  0 -1  1  15.57  6.97   9.85 -9.85 13.93  -9.85  9.85 -6.97
max cutoff 9.850
}
,   tricvec  6 = -1  0  1  15.57  6.97  -9.85  9.85 13.93   9.85 -9.85 -6.97
  tricvec  5 =  0  0  1  15.57  6.97   9.85  9.85 13.93  -9.85 -9.85 -6.97
  0.00000e+00 Box[    2]={ 1.39301e+01Box[    2]={  tricvec  7 =  0 -1  1  15.57  6.97   9.85 -9.85 13.93  -9.85  9.85 -6.97
,  9.85009e+00max cutoff 9.850
  tricvec  4 =  1  1 -1  15.57  6.97   9.85  9.85 -13.93  -9.85 -9.85  6.97
  9.85009e+00  0.00000e+00}
,  1.39301e+01 9.85009e+00 9.85009e+00   tricvec  5 =  0  0  1  15.57  6.97   9.85  9.85 13.93  -9.85 -9.85 -6.97
  tricvec  8 = -1 -1  1  15.57  6.97  -9.85 -9.85 13.93   9.85  9.85 -6.97
  tricvec  1 =  0  0 -1  15.57  6.97  -9.85 -9.85 -13.93   9.85  9.85  6.97
  1.39301e+01  tricvec  7 =  0 -1  1  15.57  6.97   9.85 -9.85 13.93  -9.85  9.85 -6.97
  tricvec  6 = -1  0  1  15.57  6.97  -9.85  9.85 13.93   9.85 -9.85 -6.97
Box[    2]={}
  9.85009e+00}
 9.85009e+00  tricvec  8 = -1 -1  1  15.57  6.97  -9.85 -9.85 13.93   9.85  9.85 -6.97
 1.39301e+01,   tricvec  1 =  0  0 -1  15.57  6.97  -9.85 -9.85 -13.93   9.85  9.85  6.97
  tricvec  5 =  0  0  1  15.57  6.97   9.85  9.85 13.93  -9.85 -9.85 -6.97
 ,  }
  1.39301e+01}
, ,    tricvec  6 = -1  0  1  15.57  6.97  -9.85  9.85 13.93   9.85 -9.85 -6.97
  tricvec  2 =  1  0 -1  15.57  6.97   9.85 -9.85 -13.93  -9.85  9.85  6.97
 }
  tricvec  8 = -1 -1  1  15.57  6.97  -9.85 -9.85 13.93   9.85  9.85 -6.97
  tricvec  7 =  0 -1  1  15.57  6.97   9.85 -9.85 13.93  -9.85  9.85 -6.97
 9.85009e+00 Box[    2]={, max cutoff 9.850
, }
 9.85009e+00  tricvec  2 =  1  0 -1  15.57  6.97   9.85 -9.85 -13.93  -9.85  9.85  6.97
  tricvec  6 = -1  0  1  15.57  6.97  -9.85  9.85 13.93   9.85 -9.85 -6.97
  1.39301e+01Box[    2]={  }
max cutoff 9.850
 9.85009e+00 9.85009e+00Box[    2]={  tricvec  7 =  0 -1  1  15.57  6.97   9.85 -9.85 13.93  -9.85  9.85 -6.97
  tricvec  3 =  0  1 -1  15.57  6.97  -9.85  9.85 -13.93   9.85 -9.85  6.97
 max cutoff 9.850
  tricvec  8 = -1 -1  1  15.57  6.97  -9.85 -9.85 13.93   9.85  9.85 -6.97
,   9.85009e+00 9.85009e+00  tricvec  1 =  0  0 -1  15.57  6.97  -9.85 -9.85 -13.93   9.85  9.85  6.97
 9.85009e+00max cutoff 9.850
,   tricvec  3 =  0  1 -1  15.57  6.97  -9.85  9.85 -13.93   9.85 -9.85  6.97
  tricvec  7 =  0 -1  1  15.57  6.97   9.85 -9.85 13.93  -9.85  9.85 -6.97
Box[    2]={}
 9.85009e+00  max cutoff 9.850
  tricvec  1 =  0  0 -1  15.57  6.97  -9.85 -9.85 -13.93   9.85  9.85  6.97
, ,  9.85009e+00  tricvec  8 = -1 -1  1  15.57  6.97  -9.85 -9.85 13.93   9.85  9.85 -6.97
  tricvec  4 =  1  1 -1  15.57  6.97   9.85  9.85 -13.93  -9.85 -9.85  6.97
Box[    2]={  tricvec  1 =  0  0 -1  15.57  6.97  -9.85 -9.85 -13.93   9.85  9.85  6.97
 9.85009e+00 , ,   tricvec  2 =  1  0 -1  15.57  6.97   9.85 -9.85 -13.93  -9.85  9.85  6.97
,   tricvec  1 =  0  0 -1  15.57  6.97  -9.85 -9.85 -13.93   9.85  9.85  6.97
 1.39301e+01  tricvec  4 =  1  1 -1  15.57  6.97   9.85  9.85 -13.93  -9.85 -9.85  6.97
  tricvec  8 = -1 -1  1  15.57  6.97  -9.85 -9.85 13.93   9.85  9.85 -6.97
 9.85009e+00max cutoff 9.850
,  Box[    2]={  tricvec  1 =  0  0 -1  15.57  6.97  -9.85 -9.85 -13.93   9.85  9.85  6.97
  tricvec  2 =  1  0 -1  15.57  6.97   9.85 -9.85 -13.93  -9.85  9.85  6.97
 1.39301e+01 1.39301e+01,   tricvec  5 =  0  0  1  15.57  6.97   9.85  9.85 13.93  -9.85 -9.85 -6.97
 9.85009e+00  tricvec  2 =  1  0 -1  15.57  6.97   9.85 -9.85 -13.93  -9.85  9.85  6.97
, Box[    2]={ 9.85009e+00 1.39301e+01  tricvec  3 =  0  1 -1  15.57  6.97  -9.85  9.85 -13.93   9.85 -9.85  6.97
 1.39301e+01  tricvec  2 =  1  0 -1  15.57  6.97   9.85 -9.85 -13.93  -9.85  9.85  6.97
}
  tricvec  5 =  0  0  1  15.57  6.97   9.85  9.85 13.93  -9.85 -9.85 -6.97
,   tricvec  1 =  0  0 -1  15.57  6.97  -9.85 -9.85 -13.93   9.85  9.85  6.97
 9.85009e+00Box[    2]={ 9.85009e+00  tricvec  2 =  1  0 -1  15.57  6.97   9.85 -9.85 -13.93  -9.85  9.85  6.97
  tricvec  3 =  0  1 -1  15.57  6.97  -9.85  9.85 -13.93   9.85 -9.85  6.97
}
}
 9.85009e+00  tricvec  6 = -1  0  1  15.57  6.97  -9.85  9.85 13.93   9.85 -9.85 -6.97
,   tricvec  3 =  0  1 -1  15.57  6.97  -9.85  9.85 -13.93   9.85 -9.85  6.97
 1.39301e+01 9.85009e+00, }
  tricvec  4 =  1  1 -1  15.57  6.97   9.85  9.85 -13.93  -9.85 -9.85  6.97
}
  tricvec  3 =  0  1 -1  15.57  6.97  -9.85  9.85 -13.93   9.85 -9.85  6.97
max cutoff 9.850
  tricvec  6 = -1  0  1  15.57  6.97  -9.85  9.85 13.93   9.85 -9.85 -6.97
 9.85009e+00  tricvec  2 =  1  0 -1  15.57  6.97   9.85 -9.85 -13.93  -9.85  9.85  6.97
,  9.85009e+00,   tricvec  3 =  0  1 -1  15.57  6.97  -9.85  9.85 -13.93   9.85 -9.85  6.97
  tricvec  4 =  1  1 -1  15.57  6.97   9.85  9.85 -13.93  -9.85 -9.85  6.97
max cutoff 9.850
max cutoff 9.850
,   tricvec  7 =  0 -1  1  15.57  6.97   9.85 -9.85 13.93  -9.85  9.85 -6.97
 9.85009e+00  tricvec  4 =  1  1 -1  15.57  6.97   9.85  9.85 -13.93  -9.85 -9.85  6.97
}
,  1.39301e+01max cutoff 9.850
  tricvec  5 =  0  0  1  15.57  6.97   9.85  9.85 13.93  -9.85 -9.85 -6.97
max cutoff 9.850
  tricvec  4 =  1  1 -1  15.57  6.97   9.85  9.85 -13.93  -9.85 -9.85  6.97
  tricvec  1 =  0  0 -1  15.57  6.97  -9.85 -9.85 -13.93   9.85  9.85  6.97
  tricvec  7 =  0 -1  1  15.57  6.97   9.85 -9.85 13.93  -9.85  9.85 -6.97
,   tricvec  3 =  0  1 -1  15.57  6.97  -9.85  9.85 -13.93   9.85 -9.85  6.97
 1.39301e+01,  9.85009e+00  tricvec  4 =  1  1 -1  15.57  6.97   9.85  9.85 -13.93  -9.85 -9.85  6.97
  tricvec  5 =  0  0  1  15.57  6.97   9.85  9.85 13.93  -9.85 -9.85 -6.97
  tricvec  1 =  0  0 -1  15.57  6.97  -9.85 -9.85 -13.93   9.85  9.85  6.97
  tricvec  1 =  0  0 -1  15.57  6.97  -9.85 -9.85 -13.93   9.85  9.85  6.97
 1.39301e+01  tricvec  8 = -1 -1  1  15.57  6.97  -9.85 -9.85 13.93   9.85  9.85 -6.97
,   tricvec  5 =  0  0  1  15.57  6.97   9.85  9.85 13.93  -9.85 -9.85 -6.97
max cutoff 9.850
 9.85009e+00}
  tricvec  1 =  0  0 -1  15.57  6.97  -9.85 -9.85 -13.93   9.85  9.85  6.97
  tricvec  6 = -1  0  1  15.57  6.97  -9.85  9.85 13.93