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  1. LAMMPS (10 Aug 2015)
  2. using 2 OpenMP thread(s) per MPI task
  3. using multi-threaded neighbor list subroutines
  4. prefer double precision OpenMP force kernels
  5. using multi-threaded neighbor list subroutines
  6. prefer double precision OpenMP force kernels
  7. Intel Package: Affinitizing MPI Tasks to 4 Cores Each
  8. [Offload] [MIC 0] [File] ../fix_intel.cpp
  9. ....
  10.  
  11. *****THERE WERE OVER THOUSNAD LINES OF DUMP FROM XEON PHI THAT I REMOVED*******
  12.  
  13. [Offload] [MIC 0] [Tag 0] [MIC->CPU Data] 8 (bytes)
  14.  
  15. orthogonal box = (-67.892 -65.493 -79.1765) to (82.108 84.507 70.8235)
  16. 5 by 5 by 6 MPI processor grid
  17. reading atoms ...
  18. 74124 atoms
  19. scanning bonds ...
  20. 4 = max bonds/atom
  21. scanning angles ...
  22. 15 = max angles/atom
  23. scanning dihedrals ...
  24. 27 = max dihedrals/atom
  25. reading bonds ...
  26. 52098 bonds
  27. reading angles ...
  28. 38443 angles
  29. reading dihedrals ...
  30. 17100 dihedrals
  31. Finding 1-2 1-3 1-4 neighbors ...
  32. Special bond factors lj: 0 0 0
  33. Special bond factors coul: 0 0 0
  34. 6 = max # of 1-2 neighbors
  35. 15 = max # of 1-3 neighbors
  36. 72 = max # of 1-4 neighbors
  37. 30 = max # of special neighbors
  38. Finding 1-2 1-3 1-4 neighbors ...
  39. Special bond factors lj: 0 0 0.5
  40. Special bond factors coul: 0 0 0.833333
  41. 6 = max # of 1-2 neighbors
  42. 15 = max # of 1-3 neighbors
  43. 72 = max # of 1-4 neighbors
  44. 30 = max # of special neighbors
  45. 73500 atoms in group MovingAtoms
  46. 624 atoms in group MoS2Atoms
  47. 1 rigid bodies with 624 atoms
  48. WARNING: Cannot count rigid body degrees-of-freedom before bodies are initialized (../fix_rigid.cpp:1093)
  49. PPPM initialization ...
  50. G vector (1/distance) = 0.160841
  51. grid = 40 40 40
  52. stencil order = 5
  53. estimated absolute RMS force accuracy = 0.0343986
  54. estimated relative force accuracy = 0.00010359
  55. using double precision FFTs
  56. 3d grid and FFT values/proc = 2197 480
  57. Last active /omp style is kspace_style pppm/omp
  58. Neighbor list info ...
  59. 1 neighbor list requests
  60. update every 1 steps, delay 0 steps, check yes
  61. master list distance cutoff = 17
  62. ghost atom cutoff = 17
  63. Setting up run ...
  64. Memory usage per processor = 23.0547 Mbytes
  65. Step TotEng E_vdwl E_coul Lx Ly Lz Temp
  66. 0 90256.782 -1539.7554 695512.31 150 150 150 299.99184
  67. 10000 -159688.49 46947.234 430700.27 150 150 150 254.90102
  68. 20000 -147572.95 48617.014 425323.07 150 150 150 306.84976
  69. 30000 -159513.12 51970.337 409896.02 150 150 150 298.58074
  70. 40000 -162495.11 53775.388 403238.35 150 150 150 300.18755
  71. 50000 -164184.49 53301.34 400701.77 150 150 150 300.24078
  72. 60000 -166623.84 54771.98 395744.96 150 150 150 300.30095
  73. 70000 -168847.09 56523.613 390496.73 150 150 150 301.06994
  74. 80000 -170933.31 57081.088 387573.94 150 150 150 298.85741
  75. 90000 -171171.63 57190.664 385873.79 150 150 150 301.28519
  76. 100000 -172120.39 57514.723 383598.89 150 150 150 302.39927
  77. Loop time of 3027.3 on 300 procs (150 MPI x 2 OpenMP) for 100000 steps with 74124 atoms
  78.  
  79. Pair time (%) = 418.66 (13.8295)
  80. Bond time (%) = 5.08921 (0.168111)
  81. Kspce time (%) = 2414.79 (79.767)
  82. Neigh time (%) = 28.1276 (0.929131)
  83. Comm time (%) = 96.0071 (3.17138)
  84. Outpt time (%) = 0.0853155 (0.0028182)
  85. Other time (%) = 64.5445 (2.13208)
  86.  
  87. Nlocal: 494.16 ave 2330 max 0 min
  88. Histogram: 76 21 17 18 0 0 0 0 0 18
  89. Nghost: 4602.79 ave 15021 max 800 min
  90. Histogram: 24 63 9 16 17 7 5 7 0 2
  91. Neighs: 373330 ave 2.36301e+06 max 0 min
  92. Histogram: 99 22 11 0 0 0 0 1 11 6
  93.  
  94. Total # of neighbors = 55999428
  95. Ave neighs/atom = 755.483
  96. Ave special neighs/atom = 2.96735
  97. Neighbor list builds = 717
  98. Dangerous builds = 0
  99. PPPM initialization ...
  100. G vector (1/distance) = 0.160841
  101. grid = 40 40 40
  102. stencil order = 5
  103. estimated absolute RMS force accuracy = 0.0343986
  104. estimated relative force accuracy = 0.00010359
  105. using double precision FFTs
  106. 3d grid and FFT values/proc = 2197 480
  107. Last active /omp style is kspace_style pppm/omp
  108. Setting up run ...
  109. Memory usage per processor = 23.073 Mbytes
  110. Step TotEng E_vdwl E_coul Lx Ly Lz Temp
  111. 100000 -172120.39 57514.723 383598.89 150 150 150 302.39927
  112. 110000 -174091.31 58790.565 379812.08 149.33445 148.94266 148.45191 301.28535
  113. 120000 -175353.54 59036.393 378354.4 147.44846 147.84024 146.61407 298.71191
  114. 130000 -176394.73 59771.067 375867.92 146.54378 145.98377 142.23971 299.72696
  115. 140000 -177371.72 60004.548 374180.67 145.73633 144.45852 137.42942 300.58091
  116. 150000 -178124.66 60213.601 373202.49 143.01091 142.73614 132.99685 299.33667
  117. 160000 -179091.47 61087.917 370545.82 140.07808 140.85212 128.40195 300.98704
  118. 170000 -180192.12 61543.068 368528.52 137.63035 138.01638 123.31187 301.8872
  119. 180000 -181233.75 61444.25 367267.97 134.95771 134.58968 118.11568 301.25127
  120. 190000 -182053.3 62266.628 365812.1 130.85439 132.19883 112.68147 300.03641
  121. 200000 -182889.07 62167.898 364850.12 127.61385 128.56692 107.91411 300.39146
  122. 210000 -183926.44 62099.386 363896.43 123.4541 125.56063 104.46594 299.48092
  123. 220000 -184463.61 63201.883 361802.6 120.15606 122.3645 102.62281 299.89543
  124. 230000 -185395.49 63464.706 360539.23 116.2708 118.77443 101.52957 299.5586
  125. 240000 -186074.86 63281.732 359666.13 112.85927 114.67094 101.20873 300.69445
  126. 250000 -186932.73 64070.81 357731.51 108.33618 110.78542 100.32755 300.75973
  127. 260000 -187526.5 64170.278 357073.19 104.67155 106.4069 99.308267 301.13415
  128. 270000 -188182.2 64306.534 356350.38 100.3874 102.08689 98.683901 300.28397
  129. 280000 -188793.92 64052.264 356054.45 96.462749 97.662177 97.926915 300.23245
  130. 290000 -189044.41 64172.051 355246.8 93.227012 94.255044 97.349767 300.22057
  131. 300000 -189016.38 63871.863 355283.44 91.341492 91.418369 96.353032 300.86846
  132. 310000 -189290.27 63720.698 355185.4 89.93083 89.330397 96.346792 299.71168
  133. 320000 -189607.81 64052.626 354556.44 89.374474 88.258761 95.857047 300.25466
  134. 330000 -189984.14 64396.35 353744.31 88.698804 87.609252 96.24154 298.76996
  135. 340000 -190382.53 64239.002 353098.06 88.091419 86.987032 96.295348 300.41513
  136. 350000 -190629.79 64630.685 352381.5 87.75715 86.931752 96.149591 301.05592
  137. 360000 -191094.1 64399.935 352092.5 87.331717 86.445237 96.68409 299.86405
  138. 370000 -191503.77 64524.136 351608.38 86.981544 86.425103 96.577084 299.46574
  139. 380000 -191612.93 64844.822 350883.82 86.851474 86.490987 96.403308 299.97636
  140. 390000 -191521.78 64843.566 350991.88 86.911087 86.173608 96.320435 299.47178
  141. 400000 -191717.45 65270.615 350258.44 86.425713 85.793769 97.016777 299.49688
  142. 410000 -192083.85 65136.491 349850.54 86.050776 85.814397 97.531461 300.50511
  143. 420000 -192253.33 64966.709 349639.2 85.935028 85.206037 97.946608 300.72492
  144. 430000 -192697.59 65046.867 349332.25 85.954864 84.920427 98.050074 299.24028
  145. 440000 -192963.82 65382.061 348615.11 85.960475 84.68365 98.248304 300.03554
  146. 450000 -192933.61 65313.127 348558.39 85.623982 84.881866 98.300719 300.27863
  147. 460000 -192778.74 65296.338 348826.89 85.565875 84.674098 98.69977 299.33398
  148. 470000 -192619.03 65468.889 348648.73 85.001589 84.848511 99.066421 299.45739
  149. 480000 -192941.31 65108.518 348923.6 84.964354 84.848116 99.019702 299.41455
  150. 490000 -192872.85 65228.566 348477.26 84.841848 84.865876 98.974578 300.5272
  151. 500000 -192756.33 65187.938 348712.83 84.632071 84.593295 99.60507 300.39973
  152. 510000 -193011.86 65310.57 348044.07 84.54587 84.562537 99.709511 300.62074
  153. 520000 -192880.31 64981.468 348686.26 84.712724 84.234909 99.814199 300.26924
  154. 530000 -193261.35 65551.263 348202.86 84.455376 84.348949 99.826927 298.92866
  155. 540000 -193269.03 65759.458 347238.87 84.300911 84.272762 100.1651 301.07373
  156. 550000 -193239.06 65433.594 348056.53 84.397486 83.867192 100.52284 299.28567
  157. 560000 -193374.79 65464.536 347845.1 84.297447 83.838315 100.88837 300.24615
  158. 570000 -193225.02 65702.709 347593.8 84.072892 83.869367 101.03013 299.78403
  159. 580000 -193235.28 65472.354 347947.34 84.368017 83.623462 101.14022 299.98081
  160. 590000 -193223.32 65257.112 348257.45 84.148959 83.502562 101.45064 300.36197
  161. 600000 -193371.91 65530.396 347694.82 84.408921 83.362615 101.31381 300.73907
  162. 610000 -193498.1 65779.875 347100.67 84.00919 82.980693 102.02261 300.54836
  163. 620000 -193606.75 66068.343 346816.76 84.015061 82.99818 102.25467 299.71443
  164. 630000 -193494.82 66018.313 346606.24 84.05494 82.771754 102.23372 300.80999
  165. 640000 -193301.46 65686.778 347398.66 83.906578 82.756807 102.52163 301.21029
  166. 650000 -193257.08 65580.069 347457.6 83.633098 82.56416 103.25821 300.38959
  167. 660000 -193227.91 65271.862 347861.62 83.531028 82.329537 103.63747 300.23883
  168. 670000 -193422 65540.817 347355.87 83.225281 82.156016 104.26757 300.22434
  169. 680000 -193331.81 65656.632 347522.23 83.081495 82.259949 104.50208 300.32392
  170. 690000 -193111.17 65542.695 347821.42 82.681032 82.172107 105.08647 300.68088
  171. 700000 -193059.26 65897.926 347365.78 82.486565 82.284232 105.1276 300.62969
  172. 710000 -193320.47 65457.281 347482.4 81.980491 82.381162 105.393 300.18013
  173. 720000 -193502.5 66011.123 346184.76 82.020989 82.019491 105.85718 301.25617
  174. 730000 -193847.28 66232.286 346202.81 81.872168 82.181092 105.98286 299.58306
  175. 740000 -193841.54 65764.49 346524.32 81.677275 82.097476 106.13811 300.71329
  176. 750000 -193887.51 65533.646 347190.17 81.380656 82.153306 106.54725 299.06001
  177. 760000 -193844.02 66149.797 346325.52 81.118908 82.372564 106.51302 299.80437
  178. 770000 -193657.45 65824.09 346731.28 80.874996 82.685272 106.65229 299.86779
  179. 780000 -193638.16 65862.302 346673.79 80.811633 82.569225 106.91442 299.82986
  180. 790000 -193677.01 65874.631 347042.42 80.42274 82.651359 107.02641 298.50931
  181. 800000 -193570.49 65830.055 346925.81 80.374999 82.547815 107.45658 300.11765
  182. 810000 -193618.9 65628.452 347397.4 80.62273 82.337638 107.38882 299.22009
  183. 820000 -193793.69 66099.355 346519.27 80.467394 82.368714 107.69898 300.26293
  184. 830000 -193703.98 65824.629 346706.01 80.536053 82.744918 106.87347 300.10938
  185. 840000 -193674.41 65861.29 347066.43 80.423366 82.652023 107.26537 299.58896
  186. 850000 -193622.75 65845.54 346769.86 80.326875 82.208828 107.89517 300.65852
  187. 860000 -193633.87 65631.155 347201.68 80.325042 81.835655 108.35381 299.39462
  188. 870000 -193794.06 65795.863 346612.08 79.905749 81.634973 109.00121 300.57846
  189. 880000 -193604.01 65376.387 347604.94 79.876504 81.779014 109.16369 300.09617
  190. 890000 -193604.81 65611.642 347475.95 79.836883 81.962493 108.82566 299.03305
  191. 900000 -193520.91 65725.445 346999.5 79.724287 81.668591 109.20344 300.72099
  192. 910000 -193592.44 65895.253 346652.32 79.248269 81.90267 109.51505 300.70126
  193. 920000 -193494.49 65707.38 347261.97 79.494858 81.743671 109.66476 299.14854
  194. 930000 -193472.46 65751.984 347368.19 79.347804 81.716577 110.01394 299.40324
  195. 940000 -193768.08 66257.275 346310.46 79.630938 81.440807 109.87847 299.86932
  196. 950000 -193565.8 65915.743 346774.92 79.630503 81.12989 110.29995 300.36596
  197. 960000 -193878.04 65577.899 346897.95 79.559542 80.995088 110.65249 300.52633
  198. 970000 -193824.61 65672.935 346486.2 79.525684 80.86218 110.51689 301.60635
  199. 980000 -193975.29 66287.246 345711.12 79.1423 80.938514 111.10225 301.65295
  200. 990000 -193696.74 66163.648 345896.94 79.092161 81.109719 110.95676 300.82515
  201. 1000000 -193745.87 66127.733 346211.36 79.130778 80.886806 111.30925 299.47911
  202. 1010000 -193685.62 65947.375 346345.42 78.967973 81.148763 111.26527 300.00215
  203. 1020000 -193862.32 65715.322 346873.63 78.9456 81.019716 111.06403 299.539
  204. 1030000 -193555.67 65593.821 347011.41 79.003406 80.517191 111.75883 301.18624
  205. 1040000 -193597.81 65832.501 346899.02 78.993503 80.428041 112.0287 299.66532
  206. 1050000 -194044.13 65534.513 346997.36 78.589224 80.387025 112.7011 299.85056
  207. 1060000 -193976.51 65844.766 346632.87 78.689404 80.257636 112.62675 300.11142
  208. 1070000 -193950.87 65862.138 346402.49 78.397657 80.32215 113.22043 299.79691
  209. 1080000 -193773.18 66116.655 346462.43 78.665208 79.793402 113.4353 299.73739
  210. 1090000 -193661.26 65635.672 346816.9 78.369923 79.679483 113.95754 300.81938
  211. 1100000 -193908.17 66055.126 346322.66 78.524838 79.089069 114.68555 299.61043
  212. 1110000 -193984.38 66113.837 346286.12 78.63324 78.974488 114.65246 299.62432
  213. 1120000 -193800.16 65758.399 346689.04 78.564521 78.968254 114.95199 300.09561
  214. 1130000 -193670.08 65606.092 347296.89 78.800922 78.965631 114.69202 299.10336
  215. 1140000 -193773.03 65949.888 346648.09 78.507894 78.961765 114.84613 299.96132
  216. 1150000 -193661.11 65721.098 346602.68 78.480459 78.873269 115.13624 301.36264
  217. 1160000 -193387.18 65844.037 347216.97 78.099379 79.093974 115.30291 299.31635
  218. 1170000 -193531.49 65746.434 346928.14 78.214438 79.156571 115.20505 300.50059
  219. 1180000 -193615.34 65731.668 346877.67 77.879011 79.114649 115.58894 300.21459
  220. 1190000 -193722.63 65914.177 347017.69 78.210615 78.918695 115.5287 298.97572
  221. 1200000 -193581.98 65842.326 346828.29 78.175352 78.904238 115.16229 299.45076
  222. 1210000 -193588.9 65457.325 347468.34 78.272655 78.991961 115.20556 300.45616
  223. 1220000 -193695 65662.966 346788.18 78.371023 78.945398 115.30133 301.15658
  224. 1230000 -193816.75 66190.888 346249.53 78.404545 78.762117 115.21687 300.06401
  225. 1240000 -193759.68 65421.036 347347.42 78.139412 78.953879 115.35003 300.15129
  226. 1250000 -193798.73 65109.167 347650.61 78.219882 78.604166 115.7713 299.01371
  227. 1260000 -193833.47 65654.052 346905.29 78.366293 78.344635 115.67988 298.65171
  228. 1270000 -193684.75 65936.618 346494.23 78.22936 78.5364 115.92045 299.50277
  229. 1280000 -193750.31 65710.963 346594.89 78.011275 78.224401 116.38293 299.76843
  230. 1290000 -193645.63 65513.521 347350.62 77.963316 78.397774 116.25384 299.60717
  231. 1300000 -193676.47 65587.866 346645.17 77.794298 78.391454 116.54959 300.33885
  232. 1310000 -193598.18 65914.332 346876.6 77.751275 78.578013 116.56506 299.60197
  233. 1320000 -193553.4 65494.477 347577.2 77.422378 78.602403 117.20266 298.95418
  234. 1330000 -193477.37 65840.384 347149.26 76.888328 78.711902 117.61732 300.12364
  235. 1340000 -193609.46 65678.072 347342.58 76.670791 78.506307 118.37292 299.42485
  236. 1350000 -193535.25 65804.028 346746.42 76.996549 78.150265 118.39408 300.92542
  237. 1360000 -193758.87 65909.625 346504.94 76.883469 77.815412 118.71728 299.62258
  238. 1370000 -193897.26 66028.246 346211.95 76.967781 77.681747 118.91221 300.25268
  239. 1380000 -193787.32 65999.122 346435.04 77.020186 77.815902 118.64267 300.36122
  240. 1390000 -193816.81 65819.637 346676.25 77.151885 77.524042 119.28432 300.23025
  241. 1400000 -193694.33 65716.264 346899.81 76.947504 77.650003 119.11045 300.40747
  242. 1410000 -193599.71 65816.421 346779.91 77.070424 77.435294 119.31704 300.05079
  243. 1420000 -193987.92 65718.762 346657.72 76.896835 77.337339 119.77117 300.1026
  244. 1430000 -193961.63 65837.582 346440.96 76.730994 77.224853 120.36004 300.11385
  245. 1440000 -193804.48 65869.68 346776.89 76.897067 76.945572 120.37422 299.21045
  246. 1450000 -193896.6 65625.675 346967.37 76.847158 76.831617 120.45922 299.83003
  247. 1460000 -193650.47 65605.845 347075.03 77.11147 76.468633 120.86871 300.41088
  248. 1470000 -193566.14 65451.756 347444.9 76.912063 76.345898 121.22498 300.62494
  249. 1480000 -193517.74 65552.648 347165.62 76.918057 76.505999 121.0387 300.93189
  250. 1490000 -193654.73 65657.421 347286.72 76.919204 76.079845 121.53257 299.02755
  251. 1500000 -193535.66 65921.472 346354.41 76.702158 76.117502 121.92419 301.57284
  252. 1510000 -193676.22 65999.115 346444.61 76.777334 76.192416 121.91665 300.67779
  253. 1520000 -193650.81 65625.528 346995.2 76.93673 75.974157 122.12482 300.75624
  254. 1530000 -193661.83 66158.484 346245.07 76.538108 75.886841 122.5158 300.66411
  255. 1540000 -193743.31 65592.8 347283.47 76.344766 75.875992 123.16531 299.60905
  256. 1550000 -193728.89 65469.401 347293.81 76.470842 75.675441 123.18168 299.86041
  257. 1560000 -193817.58 65470.496 347217.42 76.759704 75.44661 122.97054 300.28494
  258. 1570000 -193577.82 66013.477 346663.18 76.589121 75.132701 123.69779 300.4988
  259. 1580000 -193710.68 65960.622 346672.2 76.683748 75.202184 123.65725 300.70325
  260. 1590000 -193662.17 65470.858 347272.64 76.572698 75.358064 123.50484 299.61873
  261. 1600000 -193614.82 66026.205 346410.08 76.65852 75.046588 123.53799 300.06678
  262. 1610000 -193643.95 65221.033 348131.45 76.720704 74.970729 123.87298 298.47148
  263. 1620000 -193601.34 65244.522 347759.28 76.723295 74.921381 123.80708 299.07103
  264. 1630000 -193671.7 65560.331 346919.47 76.801725 74.739878 124.03532 301.99392
  265. 1640000 -193611.25 65352.244 347591.21 76.740451 74.379429 124.55171 299.1247
  266. 1650000 -193892.84 65775.181 346992.64 76.69761 74.508119 124.42038 299.8575
  267. 1660000 -193864.39 66058.488 346650.95 76.792354 74.236963 124.86126 299.46659
  268. 1670000 -193997.44 66039.099 346045.22 76.536014 74.003084 125.14897 300.64739
  269. 1680000 -193892.02 65742.801 346897.03 76.406327 73.990387 125.83139 300.70042
  270. 1690000 -194117.13 65821.352 346668.13 76.440498 73.926581 125.62033 299.32841
  271. 1700000 -193775.38 65739.614 347173.1 76.379107 73.905244 126.21149 299.57126
  272. 1710000 -193834.9 66423.467 346050.26 76.334428 73.825206 126.0228 299.64242
  273. 1720000 -193832.7 65706.789 346941.34 76.258284 73.833504 126.35427 299.23528
  274. 1730000 -194146.93 65785.005 346235.78 76.590046 73.903916 125.85244 300.48772
  275. 1740000 -193949.89 66185.454 346150.35 76.571684 73.738292 126.32332 299.72197
  276. 1750000 -193838.49 66000.401 346422.39 76.410579 73.592249 127.01699 299.81719
  277. 1760000 -194042.78 65847.388 346380.87 76.494624 73.550152 126.92092 300.09485
  278. 1770000 -193942.16 65733.977 346347.62 76.433054 73.36621 127.09818 299.99644
  279. 1780000 -193830.19 65991.075 346259.16 76.410762 73.487552 127.07779 301.30579
  280. 1790000 -193716.93 66181.309 346081 76.039687 73.312116 127.83525 301.26268
  281. 1800000 -193703.32 65933.805 346545.99 76.419308 73.157984 127.57093 300.52287
  282. 1810000 -193803.5 65555.745 347210.01 76.084495 72.963623 128.37248 300.08935
  283. 1820000 -193950.45 65593.264 347166.28 76.066353 72.794367 128.53872 299.43988
  284. 1830000 -193667.58 65788.612 346920.59 75.745211 72.690832 129.08125 299.74428
  285. 1840000 -193403.21 65422.776 347590.12 75.567786 72.654211 129.72904 300.16632
  286. 1850000 -193493.2 65504.201 347734.79 75.39601 72.854344 129.62427 300.26634
  287. 1860000 -193574.34 65511.323 347639.89 75.408466 72.968163 129.42292 299.48445
  288. 1870000 -193698.88 65684.096 347050.85 75.128079 72.892029 130.08648 300.12102
  289. 1880000 -193521.37 65946.938 347001.1 74.985346 72.848184 130.61498 300.26331
  290. 1890000 -193764.46 65806.118 346914.28 74.61625 72.816576 131.03487 300.80037
  291. 1900000 -193488.65 65437.749 347560.33 74.817864 72.693733 131.22728 300.23409
  292. 1910000 -193805.91 65570.274 347178.08 74.84831 72.604247 131.11329 299.99306
  293. 1920000 -193641.01 65441.509 347572.36 74.793978 72.548614 131.39034 299.56915
  294. 1930000 -193547.86 65609.016 347269.38 74.484567 72.89288 131.23802 300.26642
  295. 1940000 -193662.62 65488.479 347462.86 74.374312 72.643977 132.0833 300.03637
  296. 1950000 -193855.66 65629.721 347201.54 74.229468 72.706344 132.30443 298.89846
  297. 1960000 -193582.29 65514.901 347373.13 74.090318 72.684981 132.50699 300.24039
  298. 1970000 -193415.92 65545.914 347357.72 73.876503 72.493386 133.2952 300.85367
  299. 1980000 -193474.97 65844.61 346804.72 73.635973 72.323963 133.66527 299.45912
  300. 1990000 -193648.53 65454.879 347576.36 73.34327 72.442043 134.1838 299.17969
  301. 2000000 -193561.51 65887.211 346830.44 72.93792 72.378483 134.79239 301.53937
  302. 2010000 -193660.47 65942.342 346544.68 72.934204 72.143312 135.51628 299.86064
  303. 2020000 -193618.07 65455.627 347389.97 72.881465 72.221978 135.37978 299.65464
  304. 2030000 -193465.98 65286.254 347700.56 72.792088 72.151808 135.77255 300.41799
  305. 2040000 -193513.97 66092.898 346378.22 72.810836 72.197279 135.51325 301.18267
  306. 2050000 -193733.46 65865.04 346725.03 72.746718 71.891734 136.0749 299.29441
  307. 2060000 -193915.2 65825.296 346667.18 72.646243 71.893296 136.25702 300.06233
  308. 2070000 -193791.72 65893.627 346535.79 72.709253 71.605113 137.08364 299.46996
  309. 2080000 -193985.96 66392.871 345881.29 72.562949 71.611027 137.36219 300.35801
  310. 2090000 -193880.77 65845.741 346602.8 72.594249 71.661066 137.29208 300.48037
  311. 2100000 -193908 66127.555 346364.12 72.550358 71.264728 137.71806 300.57672
  312. 2110000 -193703.51 65848.288 346905.67 72.511321 71.289117 138.19618 299.52137
  313. 2120000 -193572.56 65766.675 346929.59 72.401723 71.011662 138.52596 300.59826
  314. 2130000 -193694.47 66012.916 346784.07 72.377748 70.879723 138.83344 299.78605
  315. 2140000 -193786.86 65905.466 346658.46 72.433177 70.741993 139.15822 299.33126
  316. 2150000 -193629.32 66332.518 346257.21 72.418587 70.432739 139.86394 300.12571
  317. 2160000 -193614.07 65449.062 347588.62 72.387094 70.298668 140.30091 298.84014
  318. 2170000 -193875.49 66223.239 345990.41 72.297144 70.394267 140.18758 299.68917
  319. 2180000 -193856.86 65944.092 346321.53 72.355966 70.293674 140.11456 300.68613
  320. 2190000 -193985.15 66177.524 346028.91 72.04005 70.297321 140.31166 301.05887
  321. 2200000 -193722.79 66054.792 346314.59 71.757714 70.104154 141.49173 300.63822
  322. 2210000 -193688.54 66035.534 346506.25 71.772039 69.971958 141.93207 300.05367
  323. 2220000 -193438.31 65929.821 346822.29 71.77669 69.845237 141.86031 299.71492
  324. 2230000 -193711.98 66020.435 346571.38 71.460598 70.160043 142.08187 299.15402
  325. 2240000 -193680.86 65988.038 346226.62 71.35848 69.969522 142.54347 300.85792
  326. 2250000 -193794.88 65521.326 347250.85 71.16967 69.98108 143.14501 299.25336
  327. 2260000 -193879.49 65949.189 346347.11 70.871252 69.888875 143.95116 300.08499
  328. 2270000 -193817.36 66259.833 346406.71 70.651486 69.845037 144.43243 298.75953
  329. 2280000 -193651.86 66282.479 346315.54 70.462513 69.850244 145.04878 299.2683
  330. 2290000 -193557.96 66068.697 346387.96 70.561982 69.793762 144.8027 301.33771
  331. 2300000 -193897.19 65765.617 347016.31 70.45253 69.588397 145.25776 299.98231
  332. 2310000 -193698.72 65714.26 347108.27 70.356156 69.445943 146.02126 298.76532
  333. 2320000 -193813.01 65957.871 346475.59 70.181137 69.376436 146.1893 300.59528
  334. 2330000 -193776.94 65948.017 346640.49 69.998928 69.335555 146.95453 299.67473
  335. 2340000 -193695.95 65915.179 346476.97 69.846954 69.320469 147.19327 300.35508
  336. 2350000 -193582.91 65883.939 346986.87 70.060999 69.112802 147.358 299.9359
  337. 2360000 -193747.73 66126.708 346755.48 69.858945 69.067512 147.72508 299.39147
  338. 2370000 -193758.93 65819.139 346717.69 69.94721 68.816315 147.86386 299.51466
  339. 2380000 -193793.6 65888.501 346891.03 70.097036 68.56945 148.37354 299.61477
  340. 2390000 -194032.31 66253.656 345873.85 70.207464 68.208287 148.45426 300.41878
  341. 2400000 -193712.24 65873.11 346606.18 69.874319 68.343665 149.27605 300.16601
  342. 2410000 -193679.47 65826.079 346792.25 69.684651 68.392731 149.43617 299.0454
  343. 2420000 -193612.66 66108.658 346429.44 69.404577 68.661978 149.65373 300.75141
  344. 2430000 -194013.54 65719.867 346952.29 69.44792 68.568661 149.78615 298.56992
  345. 2440000 -194037.91 65981.87 346124.8 69.384034 68.727333 149.79766 300.59061
  346. 2450000 -193869.81 66135.617 346225.46 69.044234 68.77927 150.11355 299.60018
  347. ERROR on proc 58: Out of range atoms - cannot compute PPPM (../pppm.cpp:1918)
  348. Application 685460 exit codes: 134
  349. Application 685460 exit signals: Killed
  350. Application 685460 resources: utime ~53997s, stime ~462s, Rss ~42612, inblocks ~738252, outblocks ~2307784
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