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  1. <!DOCTYPE HTML PUBLIC "-//W3C//DTD HTML 4.0//EN" "http://www.w3.org/TR/REC-html40/strict.dtd">
  2. <html><head><meta name="qrichtext" content="1" /><title>vasp</title><style type="text/css">
  3. p, li { white-space: pre-wrap; }
  4. </style></head><body style=" font-family:'.SF NS Text'; font-size:13pt; font-weight:400; font-style:normal;">
  5. <p align="center" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><span style=" font-family:'-webkit-standard'; font-size:x-large; font-weight:600; color:#000000;"><br />VASP the GUIDE</span></p>
  6. <p style=" margin-top:12px; margin-bottom:12px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><span style=" font-family:'-webkit-standard'; color:#000000;"><br /><br /><br /><br /><br /><br /></span></p>
  7. <p align="center" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><span style=" font-family:'-webkit-standard'; font-size:large; color:#000000;">written by Georg Kresse, Martijn Marsman, and Jürgen Furthmüller <br />Computational Materials Physics, Faculty of Physics, Universität Wien, <br />Sensengasse 8/12, A-1090 Wien, Austria <br /><br /><br /><br /><br /><br /><br /><br /><br /><br /></span></p>
  8. <p style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><span style=" font-family:'-webkit-standard'; color:#000000;">Vienna, April 20, 2016 <br />This document can be retrieved from: http://cms.mpi.univie.ac.at/VASP/ <br />Please check section </span><a href="https://cms.mpi.univie.ac.at/vasp/vasp/New_features_added.html#new-features"><span style=" font-family:'-webkit-standard'; text-decoration: underline; color:#0000ff;">1</span></a><span style=" font-family:'-webkit-standard'; color:#000000;"> for new features</span></p>
  9. <p style=" margin-top:12px; margin-bottom:12px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><span style=" font-family:'-webkit-standard'; color:#000000;"><br /></span></p>
  10. <hr />
  11. <ul style="margin-top: 0px; margin-bottom: 0px; margin-left: 0px; margin-right: 0px; -qt-list-indent: 1;"><li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:12px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html18"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Introduction.html"><span style=" text-decoration: underline; color:#0000ff;">I</span></a><span style=" text-decoration: underline; color:#0000ff;">ntroduction</span></li>
  12. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html19"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Contents.html"><span style=" text-decoration: underline; color:#0000ff;">C</span></a><span style=" text-decoration: underline; color:#0000ff;">ontents</span></li>
  13. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html20"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/New_features_added.html"><span style=" text-decoration: underline; color:#0000ff;">N</span></a><span style=" text-decoration: underline; color:#0000ff;">ew features added</span></li>
  14. <ul style="margin-top: 0px; margin-bottom: 0px; margin-left: 0px; margin-right: 0px; -qt-list-indent: 2;"><li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html21"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/VASP_4_6.html"><span style=" text-decoration: underline; color:#0000ff;">V</span></a><span style=" text-decoration: underline; color:#0000ff;">ASP 4.6</span></li>
  15. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html22"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/VASP_5_2_2_Release_note.html"><span style=" text-decoration: underline; color:#0000ff;">V</span></a><span style=" text-decoration: underline; color:#0000ff;">ASP 5.2.2: Release note</span></li>
  16. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html23"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/VASP_5_2_Manual_updates.html"><span style=" text-decoration: underline; color:#0000ff;">V</span></a><span style=" text-decoration: underline; color:#0000ff;">ASP 5.2: Manual updates</span></li></ul>
  17. <p style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:1; text-indent:0px;"><span style=" font-family:'-webkit-standard'; color:#000000;"><br /></span></p>
  18. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html24"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/VASP_introduction.html"><span style=" text-decoration: underline; color:#0000ff;">V</span></a><span style=" text-decoration: underline; color:#0000ff;">ASP an introduction</span></li>
  19. <ul style="margin-top: 0px; margin-bottom: 0px; margin-left: 0px; margin-right: 0px; -qt-list-indent: 2;"><li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html25"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/History_VASP.html"><span style=" text-decoration: underline; color:#0000ff;">H</span></a><span style=" text-decoration: underline; color:#0000ff;">istory of VASP</span></li>
  20. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html26"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Outline_structure_program.html"><span style=" text-decoration: underline; color:#0000ff;">O</span></a><span style=" text-decoration: underline; color:#0000ff;">utline of the structure of the program</span></li>
  21. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html27"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Tutorial_first_steps.html"><span style=" text-decoration: underline; color:#0000ff;">T</span></a><span style=" text-decoration: underline; color:#0000ff;">utorial, first steps</span></li></ul>
  22. <ul style="margin-top: 0px; margin-bottom: 0px; margin-left: 0px; margin-right: 0px; -qt-list-indent: 3;"><li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html28"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/diamond.html"><span style=" text-decoration: underline; color:#0000ff;">d</span></a><span style=" text-decoration: underline; color:#0000ff;">iamond</span></li></ul>
  23. <p style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:1; text-indent:0px;"><span style=" font-family:'-webkit-standard'; color:#000000;"><br /></span></p>
  24. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html29"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/installation_VASP.html"><span style=" text-decoration: underline; color:#0000ff;">T</span></a><span style=" text-decoration: underline; color:#0000ff;">he installation of VASP</span></li>
  25. <ul style="margin-top: 0px; margin-bottom: 0px; margin-left: 0px; margin-right: 0px; -qt-list-indent: 2;"><li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html30"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/How_obtain_VASP_package.html"><span style=" text-decoration: underline; color:#0000ff;">H</span></a><span style=" text-decoration: underline; color:#0000ff;">ow to obtain the VASP package</span></li>
  26. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html31"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Installation_VASP.html"><span style=" text-decoration: underline; color:#0000ff;">I</span></a><span style=" text-decoration: underline; color:#0000ff;">nstallation of VASP</span></li>
  27. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html32"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Compiling_maintaining_VASP.html"><span style=" text-decoration: underline; color:#0000ff;">C</span></a><span style=" text-decoration: underline; color:#0000ff;">ompiling and maintaining VASP</span></li>
  28. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html33"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Updating_VASP.html"><span style=" text-decoration: underline; color:#0000ff;">U</span></a><span style=" text-decoration: underline; color:#0000ff;">pdating VASP</span></li>
  29. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html34"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Pre_compiler_flags_overview_parallel_version_Gamma_point_only_version.html"><span style=" text-decoration: underline; color:#0000ff;">P</span></a><span style=" text-decoration: underline; color:#0000ff;">re-compiler flags overview, parallel version and Gamma point only version</span></li>
  30. <ul style="margin-top: 0px; margin-bottom: 0px; margin-left: 0px; margin-right: 0px; -qt-list-indent: 3;"><li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html35"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/single_BLAS.html"><span style=" text-decoration: underline; color:#0000ff;">s</span></a><span style=" text-decoration: underline; color:#0000ff;">ingle_BLAS</span></li>
  31. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html36"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/vector.html"><span style=" text-decoration: underline; color:#0000ff;">v</span></a><span style=" text-decoration: underline; color:#0000ff;">ector</span></li>
  32. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html37"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/essl.html"><span style=" text-decoration: underline; color:#0000ff;">e</span></a><span style=" text-decoration: underline; color:#0000ff;">ssl</span></li>
  33. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html38"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/NOZTRMM.html"><span style=" text-decoration: underline; color:#0000ff;">N</span></a><span style=" text-decoration: underline; color:#0000ff;">OZTRMM</span></li>
  34. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html39"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/REAL_to_DBLE_VASP_3_X_only.html"><span style=" text-decoration: underline; color:#0000ff;">R</span></a><span style=" text-decoration: underline; color:#0000ff;">EAL_to_DBLE (VASP.3.X only)</span></li>
  35. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html40"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/NGXhalf_NGZhalf.html"><span style=" text-decoration: underline; color:#0000ff;">N</span></a><span style=" text-decoration: underline; color:#0000ff;">GXhalf, NGZhalf</span></li>
  36. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html41"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/wNGXhalf_wNGZhalf.html"><span style=" text-decoration: underline; color:#0000ff;">w</span></a><span style=" text-decoration: underline; color:#0000ff;">NGXhalf, wNGZhalf</span></li>
  37. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html42"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/debug.html"><span style=" text-decoration: underline; color:#0000ff;">d</span></a><span style=" text-decoration: underline; color:#0000ff;">ebug</span></li>
  38. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html43"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/noSTOPCAR.html"><span style=" text-decoration: underline; color:#0000ff;">n</span></a><span style=" text-decoration: underline; color:#0000ff;">oSTOPCAR</span></li>
  39. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html44"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/F90_T3D.html"><span style=" text-decoration: underline; color:#0000ff;">F</span></a><span style=" text-decoration: underline; color:#0000ff;">90_T3D</span></li>
  40. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html45"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/MY_TINY.html"><span style=" text-decoration: underline; color:#0000ff;">M</span></a><span style=" text-decoration: underline; color:#0000ff;">Y_TINY</span></li>
  41. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html46"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/avoidalloc.html"><span style=" text-decoration: underline; color:#0000ff;">a</span></a><span style=" text-decoration: underline; color:#0000ff;">voidalloc</span></li>
  42. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html47"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/pro_loop.html"><span style=" text-decoration: underline; color:#0000ff;">p</span></a><span style=" text-decoration: underline; color:#0000ff;">ro_loop</span></li>
  43. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html48"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/WAVECAR_double.html"><span style=" text-decoration: underline; color:#0000ff;">W</span></a><span style=" text-decoration: underline; color:#0000ff;">AVECAR_double</span></li>
  44. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html49"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/MPI.html"><span style=" text-decoration: underline; color:#0000ff;">M</span></a><span style=" text-decoration: underline; color:#0000ff;">PI</span></li>
  45. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html50"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/MPI_CHAIN.html"><span style=" text-decoration: underline; color:#0000ff;">M</span></a><span style=" text-decoration: underline; color:#0000ff;">PI_CHAIN</span></li>
  46. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html51"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/use_collective.html"><span style=" text-decoration: underline; color:#0000ff;">u</span></a><span style=" text-decoration: underline; color:#0000ff;">se_collective</span></li>
  47. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html52"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/MPI_BLOCK.html"><span style=" text-decoration: underline; color:#0000ff;">M</span></a><span style=" text-decoration: underline; color:#0000ff;">PI_BLOCK</span></li>
  48. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html53"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/T3D_SMA.html"><span style=" text-decoration: underline; color:#0000ff;">T</span></a><span style=" text-decoration: underline; color:#0000ff;">3D_SMA</span></li>
  49. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html54"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/scaLAPACK.html"><span style=" text-decoration: underline; color:#0000ff;">s</span></a><span style=" text-decoration: underline; color:#0000ff;">caLAPACK</span></li>
  50. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html55"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/CRAY_MPP.html"><span style=" text-decoration: underline; color:#0000ff;">C</span></a><span style=" text-decoration: underline; color:#0000ff;">RAY_MPP</span></li></ul>
  51. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html56"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Compiling_VASP_4_X_f90_compilers.html"><span style=" text-decoration: underline; color:#0000ff;">C</span></a><span style=" text-decoration: underline; color:#0000ff;">ompiling VASP.4.X, f90 compilers</span></li>
  52. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html57"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Performance_optimisation_VASP.html"><span style=" text-decoration: underline; color:#0000ff;">P</span></a><span style=" text-decoration: underline; color:#0000ff;">erformance optimisation of VASP</span></li>
  53. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html58"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Performance_profile_some_machines_buyers_guide.html"><span style=" text-decoration: underline; color:#0000ff;">P</span></a><span style=" text-decoration: underline; color:#0000ff;">erformance profile of some machines, buyers guide</span></li>
  54. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html59"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Performance_serial_code.html"><span style=" text-decoration: underline; color:#0000ff;">P</span></a><span style=" text-decoration: underline; color:#0000ff;">erformance of serial code</span></li>
  55. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html60"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Performance_parallel_code_on_various_machines.html"><span style=" text-decoration: underline; color:#0000ff;">P</span></a><span style=" text-decoration: underline; color:#0000ff;">erformance of parallel code on various machines</span></li></ul>
  56. <p style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:1; text-indent:0px;"><span style=" font-family:'-webkit-standard'; color:#000000;"><br /></span></p>
  57. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html61"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Parallelization_VASP_4.html"><span style=" text-decoration: underline; color:#0000ff;">P</span></a><span style=" text-decoration: underline; color:#0000ff;">arallelization of VASP.4</span></li>
  58. <ul style="margin-top: 0px; margin-bottom: 0px; margin-left: 0px; margin-right: 0px; -qt-list-indent: 2;"><li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html62"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Fortan_90_VASP.html"><span style=" text-decoration: underline; color:#0000ff;">F</span></a><span style=" text-decoration: underline; color:#0000ff;">ortan 90 and VASP</span></li>
  59. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html63"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Most_important_Structures_types_in_VASP_4_2.html"><span style=" text-decoration: underline; color:#0000ff;">M</span></a><span style=" text-decoration: underline; color:#0000ff;">ost important Structures and types in VASP.4.2</span></li>
  60. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html64"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Parallelization_VASP_4_x.html"><span style=" text-decoration: underline; color:#0000ff;">P</span></a><span style=" text-decoration: underline; color:#0000ff;">arallelization of VASP.4.x</span></li>
  61. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html65"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Files_in_parallel_version_serial_version.html"><span style=" text-decoration: underline; color:#0000ff;">F</span></a><span style=" text-decoration: underline; color:#0000ff;">iles in parallel version and serial version</span></li>
  62. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html66"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Restrictions_in_VASP_4_X_restrictions_due_parallelization.html"><span style=" text-decoration: underline; color:#0000ff;">R</span></a><span style=" text-decoration: underline; color:#0000ff;">estrictions in VASP.4.X and restrictions due to parallelization</span></li></ul>
  63. <p style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:1; text-indent:0px;"><span style=" font-family:'-webkit-standard'; color:#000000;"><br /></span></p>
  64. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html67"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Files_used_VASP.html"><span style=" text-decoration: underline; color:#0000ff;">F</span></a><span style=" text-decoration: underline; color:#0000ff;">iles used by VASP</span></li>
  65. <ul style="margin-top: 0px; margin-bottom: 0px; margin-left: 0px; margin-right: 0px; -qt-list-indent: 2;"><li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html68"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/INCAR_file.html"><span style=" text-decoration: underline; color:#0000ff;">I</span></a><span style=" text-decoration: underline; color:#0000ff;">NCAR file</span></li>
  66. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html69"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/STOPCAR_file.html"><span style=" text-decoration: underline; color:#0000ff;">S</span></a><span style=" text-decoration: underline; color:#0000ff;">TOPCAR file</span></li>
  67. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html70"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/stdout_OSZICAR_file.html"><span style=" text-decoration: underline; color:#0000ff;">s</span></a><span style=" text-decoration: underline; color:#0000ff;">tdout, and OSZICAR-file</span></li>
  68. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html71"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/POTCAR_file.html"><span style=" text-decoration: underline; color:#0000ff;">P</span></a><span style=" text-decoration: underline; color:#0000ff;">OTCAR file</span></li>
  69. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html72"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/KPOINTS_file.html"><span style=" text-decoration: underline; color:#0000ff;">K</span></a><span style=" text-decoration: underline; color:#0000ff;">POINTS file</span></li>
  70. <ul style="margin-top: 0px; margin-bottom: 0px; margin-left: 0px; margin-right: 0px; -qt-list-indent: 3;"><li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html73"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Entering_all_k_points_explicitly.html"><span style=" text-decoration: underline; color:#0000ff;">E</span></a><span style=" text-decoration: underline; color:#0000ff;">ntering all k-points explicitly</span></li>
  71. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html74"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Strings_k_points_bandstructure_calculations.html"><span style=" text-decoration: underline; color:#0000ff;">S</span></a><span style=" text-decoration: underline; color:#0000ff;">trings of k-points for bandstructure calculations</span></li>
  72. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html75"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Automatic_k_mesh_generation.html"><span style=" text-decoration: underline; color:#0000ff;">A</span></a><span style=" text-decoration: underline; color:#0000ff;">utomatic k-mesh generation</span></li>
  73. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html76"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/hexagonal_lattices.html"><span style=" text-decoration: underline; color:#0000ff;">h</span></a><span style=" text-decoration: underline; color:#0000ff;">exagonal lattices</span></li></ul>
  74. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html77"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/IBZKPT_file.html"><span style=" text-decoration: underline; color:#0000ff;">I</span></a><span style=" text-decoration: underline; color:#0000ff;">BZKPT file</span></li>
  75. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html78"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/POSCAR_file.html"><span style=" text-decoration: underline; color:#0000ff;">P</span></a><span style=" text-decoration: underline; color:#0000ff;">OSCAR file</span></li>
  76. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html79"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/CONTCAR_file.html"><span style=" text-decoration: underline; color:#0000ff;">C</span></a><span style=" text-decoration: underline; color:#0000ff;">ONTCAR file</span></li>
  77. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html80"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/EXHCAR_file.html"><span style=" text-decoration: underline; color:#0000ff;">E</span></a><span style=" text-decoration: underline; color:#0000ff;">XHCAR file</span></li>
  78. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html81"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/CHGCAR_file.html"><span style=" text-decoration: underline; color:#0000ff;">C</span></a><span style=" text-decoration: underline; color:#0000ff;">HGCAR file</span></li>
  79. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html82"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/CHG_file.html"><span style=" text-decoration: underline; color:#0000ff;">C</span></a><span style=" text-decoration: underline; color:#0000ff;">HG file</span></li>
  80. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html83"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/WAVECAR_file.html"><span style=" text-decoration: underline; color:#0000ff;">W</span></a><span style=" text-decoration: underline; color:#0000ff;">AVECAR file</span></li>
  81. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html84"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/TMPCAR_file.html"><span style=" text-decoration: underline; color:#0000ff;">T</span></a><span style=" text-decoration: underline; color:#0000ff;">MPCAR file</span></li>
  82. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html85"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/EIGENVALUE_file.html"><span style=" text-decoration: underline; color:#0000ff;">E</span></a><span style=" text-decoration: underline; color:#0000ff;">IGENVALUE file</span></li>
  83. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html86"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/DOSCAR_file.html"><span style=" text-decoration: underline; color:#0000ff;">D</span></a><span style=" text-decoration: underline; color:#0000ff;">OSCAR file</span></li>
  84. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html87"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/PROCAR_file.html"><span style=" text-decoration: underline; color:#0000ff;">P</span></a><span style=" text-decoration: underline; color:#0000ff;">ROCAR file</span></li>
  85. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html88"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/PCDAT_file.html"><span style=" text-decoration: underline; color:#0000ff;">P</span></a><span style=" text-decoration: underline; color:#0000ff;">CDAT file</span></li>
  86. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html89"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/XDATCAR_file.html"><span style=" text-decoration: underline; color:#0000ff;">X</span></a><span style=" text-decoration: underline; color:#0000ff;">DATCAR file</span></li>
  87. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html90"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/LOCPOT_file.html"><span style=" text-decoration: underline; color:#0000ff;">L</span></a><span style=" text-decoration: underline; color:#0000ff;">OCPOT file</span></li>
  88. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html91"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/ELFCAR_file.html"><span style=" text-decoration: underline; color:#0000ff;">E</span></a><span style=" text-decoration: underline; color:#0000ff;">LFCAR file</span></li>
  89. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html92"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/PROOUT_file.html"><span style=" text-decoration: underline; color:#0000ff;">P</span></a><span style=" text-decoration: underline; color:#0000ff;">ROOUT file</span></li>
  90. <ul style="margin-top: 0px; margin-bottom: 0px; margin-left: 0px; margin-right: 0px; -qt-list-indent: 3;"><li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html93"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Format.html"><span style=" text-decoration: underline; color:#0000ff;">F</span></a><span style=" text-decoration: underline; color:#0000ff;">ormat:</span></li></ul>
  91. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html94"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/PRJCAR_file.html"><span style=" text-decoration: underline; color:#0000ff;">P</span></a><span style=" text-decoration: underline; color:#0000ff;">RJCAR file</span></li>
  92. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html95"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/makeparam_utility.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">m</span></a><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">akeparam</span><a href="https://cms.mpi.univie.ac.at/vasp/vasp/makeparam_utility.html"><span style=" text-decoration: underline; color:#0000ff;"> utility</span></a></li>
  93. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html96"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Memory_requirements.html"><span style=" text-decoration: underline; color:#0000ff;">M</span></a><span style=" text-decoration: underline; color:#0000ff;">emory requirements</span></li></ul>
  94. <p style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:1; text-indent:0px;"><span style=" font-family:'-webkit-standard'; color:#000000;"><br /></span></p>
  95. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html97"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/INCAR_File.html"><span style=" text-decoration: underline; color:#0000ff;">T</span></a><span style=" text-decoration: underline; color:#0000ff;">he INCAR File</span></li>
  96. <ul style="margin-top: 0px; margin-bottom: 0px; margin-left: 0px; margin-right: 0px; -qt-list-indent: 2;"><li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html98"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/All_parameters_or_at_least_most.html"><span style=" text-decoration: underline; color:#0000ff;">A</span></a><span style=" text-decoration: underline; color:#0000ff;">ll parameters (or at least most)</span></li>
  97. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html99"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Frequently_used_settings_in_INCAR_file.html"><span style=" text-decoration: underline; color:#0000ff;">F</span></a><span style=" text-decoration: underline; color:#0000ff;">requently used settings in the INCAR file</span></li>
  98. <ul style="margin-top: 0px; margin-bottom: 0px; margin-left: 0px; margin-right: 0px; -qt-list-indent: 3;"><li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html100"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Static_calculations.html"><span style=" text-decoration: underline; color:#0000ff;">S</span></a><span style=" text-decoration: underline; color:#0000ff;">tatic calculations</span></li>
  99. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html101"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Continuation_calculation.html"><span style=" text-decoration: underline; color:#0000ff;">C</span></a><span style=" text-decoration: underline; color:#0000ff;">ontinuation of a calculation</span></li>
  100. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html102"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Recommended_minimum_setup.html"><span style=" text-decoration: underline; color:#0000ff;">R</span></a><span style=" text-decoration: underline; color:#0000ff;">ecommended minimum setup</span></li>
  101. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html103"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Efficient_relaxation_from_unreasonable_starting_guess.html"><span style=" text-decoration: underline; color:#0000ff;">E</span></a><span style=" text-decoration: underline; color:#0000ff;">fficient relaxation from an unreasonable starting guess</span></li>
  102. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html104"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Efficient_relaxation_from_pre_converged_starting_guess.html"><span style=" text-decoration: underline; color:#0000ff;">E</span></a><span style=" text-decoration: underline; color:#0000ff;">fficient relaxation from a pre-converged starting guess</span></li>
  103. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html105"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Molecular_dynamics.html"><span style=" text-decoration: underline; color:#0000ff;">M</span></a><span style=" text-decoration: underline; color:#0000ff;">olecular dynamics</span></li>
  104. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html106"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Making_calculations_faster.html"><span style=" text-decoration: underline; color:#0000ff;">M</span></a><span style=" text-decoration: underline; color:#0000ff;">aking the calculations faster</span></li></ul>
  105. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html107"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/NGX_NGY_NGZ_NGXF_NGYF_NGZF_tags.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">N</span></a><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">GX</span><a href="https://cms.mpi.univie.ac.at/vasp/vasp/NGX_NGY_NGZ_NGXF_NGYF_NGZF_tags.html"><span style=" text-decoration: underline; color:#0000ff;">, </span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/NGX_NGY_NGZ_NGXF_NGYF_NGZF_tags.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">NGY</span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/NGX_NGY_NGZ_NGXF_NGYF_NGZF_tags.html"><span style=" text-decoration: underline; color:#0000ff;">, </span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/NGX_NGY_NGZ_NGXF_NGYF_NGZF_tags.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">NGZ</span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/NGX_NGY_NGZ_NGXF_NGYF_NGZF_tags.html"><span style=" text-decoration: underline; color:#0000ff;"> and </span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/NGX_NGY_NGZ_NGXF_NGYF_NGZF_tags.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">NGXF</span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/NGX_NGY_NGZ_NGXF_NGYF_NGZF_tags.html"><span style=" text-decoration: underline; color:#0000ff;">, </span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/NGX_NGY_NGZ_NGXF_NGYF_NGZF_tags.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">NGYF</span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/NGX_NGY_NGZ_NGXF_NGYF_NGZF_tags.html"><span style=" text-decoration: underline; color:#0000ff;">, </span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/NGX_NGY_NGZ_NGXF_NGYF_NGZF_tags.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">NGZF</span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/NGX_NGY_NGZ_NGXF_NGYF_NGZF_tags.html"><span style=" text-decoration: underline; color:#0000ff;">-tags</span></a></li>
  106. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html108"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/KSPACING_tag_KGAMMA_tag.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">K</span></a><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">SPACING</span><a href="https://cms.mpi.univie.ac.at/vasp/vasp/KSPACING_tag_KGAMMA_tag.html"><span style=" text-decoration: underline; color:#0000ff;">-tag and </span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/KSPACING_tag_KGAMMA_tag.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">KGAMMA</span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/KSPACING_tag_KGAMMA_tag.html"><span style=" text-decoration: underline; color:#0000ff;">-tag</span></a></li>
  107. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html109"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/NBANDS_tag.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">N</span></a><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">BANDS</span><a href="https://cms.mpi.univie.ac.at/vasp/vasp/NBANDS_tag.html"><span style=" text-decoration: underline; color:#0000ff;">-tag</span></a></li>
  108. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html110"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/NBLK_tag.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">N</span></a><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">BLK</span><a href="https://cms.mpi.univie.ac.at/vasp/vasp/NBLK_tag.html"><span style=" text-decoration: underline; color:#0000ff;">-tag</span></a></li>
  109. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html111"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/SYSTEM_tag.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">S</span></a><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">YSTEM</span><a href="https://cms.mpi.univie.ac.at/vasp/vasp/SYSTEM_tag.html"><span style=" text-decoration: underline; color:#0000ff;">-tag</span></a></li>
  110. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html112"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/NWRITE_tag.html"><span style=" text-decoration: underline; color:#0000ff;">N</span></a><span style=" text-decoration: underline; color:#0000ff;">WRITE-tag</span></li>
  111. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html113"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/ENCUT_tag.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">E</span></a><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">NCUT</span><a href="https://cms.mpi.univie.ac.at/vasp/vasp/ENCUT_tag.html"><span style=" text-decoration: underline; color:#0000ff;">-tag</span></a></li>
  112. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html114"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/ENAUG_tag.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">E</span></a><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">NAUG</span><a href="https://cms.mpi.univie.ac.at/vasp/vasp/ENAUG_tag.html"><span style=" text-decoration: underline; color:#0000ff;">-tag</span></a></li>
  113. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html115"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/PREC_tag.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">P</span></a><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">REC</span><a href="https://cms.mpi.univie.ac.at/vasp/vasp/PREC_tag.html"><span style=" text-decoration: underline; color:#0000ff;">-tag</span></a></li>
  114. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html116"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/ISPIN_tag.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">I</span></a><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">SPIN</span><a href="https://cms.mpi.univie.ac.at/vasp/vasp/ISPIN_tag.html"><span style=" text-decoration: underline; color:#0000ff;">-tag</span></a></li>
  115. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html117"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/MAGMOM_tag.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">M</span></a><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">AGMOM</span><a href="https://cms.mpi.univie.ac.at/vasp/vasp/MAGMOM_tag.html"><span style=" text-decoration: underline; color:#0000ff;">-tag</span></a></li>
  116. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html118"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/ISTART_tag.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">I</span></a><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">START</span><a href="https://cms.mpi.univie.ac.at/vasp/vasp/ISTART_tag.html"><span style=" text-decoration: underline; color:#0000ff;">-tag</span></a></li>
  117. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html119"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/ICHARG_tag.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">I</span></a><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">CHARG</span><a href="https://cms.mpi.univie.ac.at/vasp/vasp/ICHARG_tag.html"><span style=" text-decoration: underline; color:#0000ff;">-tag</span></a></li>
  118. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html120"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/INIWAV_tag.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">I</span></a><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">NIWAV</span><a href="https://cms.mpi.univie.ac.at/vasp/vasp/INIWAV_tag.html"><span style=" text-decoration: underline; color:#0000ff;">-tag</span></a></li>
  119. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html121"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/NELM_NELMIN_NELMDL_tag.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">N</span></a><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">ELM</span><a href="https://cms.mpi.univie.ac.at/vasp/vasp/NELM_NELMIN_NELMDL_tag.html"><span style=" text-decoration: underline; color:#0000ff;">, </span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/NELM_NELMIN_NELMDL_tag.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">NELMIN</span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/NELM_NELMIN_NELMDL_tag.html"><span style=" text-decoration: underline; color:#0000ff;"> and </span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/NELM_NELMIN_NELMDL_tag.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">NELMDL</span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/NELM_NELMIN_NELMDL_tag.html"><span style=" text-decoration: underline; color:#0000ff;">-tag</span></a></li>
  120. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html122"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/EDIFF_tag.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">E</span></a><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">DIFF</span><a href="https://cms.mpi.univie.ac.at/vasp/vasp/EDIFF_tag.html"><span style=" text-decoration: underline; color:#0000ff;">-tag</span></a></li>
  121. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html123"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/EDIFFG_tag.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">E</span></a><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">DIFFG</span><a href="https://cms.mpi.univie.ac.at/vasp/vasp/EDIFFG_tag.html"><span style=" text-decoration: underline; color:#0000ff;">-tag</span></a></li>
  122. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html124"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/NSW_tag.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">N</span></a><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">SW</span><a href="https://cms.mpi.univie.ac.at/vasp/vasp/NSW_tag.html"><span style=" text-decoration: underline; color:#0000ff;">-tag</span></a></li>
  123. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html125"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/NBLOCK_KBLOCK_tag.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">N</span></a><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">BLOCK</span><a href="https://cms.mpi.univie.ac.at/vasp/vasp/NBLOCK_KBLOCK_tag.html"><span style=" text-decoration: underline; color:#0000ff;"> and </span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/NBLOCK_KBLOCK_tag.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">KBLOCK</span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/NBLOCK_KBLOCK_tag.html"><span style=" text-decoration: underline; color:#0000ff;">-tag</span></a></li>
  124. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html126"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/IBRION_tag_NFREE_tag.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">I</span></a><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">BRION</span><a href="https://cms.mpi.univie.ac.at/vasp/vasp/IBRION_tag_NFREE_tag.html"><span style=" text-decoration: underline; color:#0000ff;">-tag, </span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/IBRION_tag_NFREE_tag.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">NFREE</span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/IBRION_tag_NFREE_tag.html"><span style=" text-decoration: underline; color:#0000ff;">-tag</span></a></li>
  125. <ul style="margin-top: 0px; margin-bottom: 0px; margin-left: 0px; margin-right: 0px; -qt-list-indent: 3;"><li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html127"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/IBRION_1.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">I</span></a><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">BRION=-1</span></li>
  126. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html128"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/IBRION_0.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">I</span></a><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">BRION</span><a href="https://cms.mpi.univie.ac.at/vasp/vasp/IBRION_0.html"><span style=" text-decoration: underline; color:#0000ff;">=0</span></a></li>
  127. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html129"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/IBRION_1_I.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">I</span></a><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">BRION</span><a href="https://cms.mpi.univie.ac.at/vasp/vasp/IBRION_1_I.html"><span style=" text-decoration: underline; color:#0000ff;">=1</span></a></li>
  128. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html130"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/IBRION_2.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">I</span></a><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">BRION</span><a href="https://cms.mpi.univie.ac.at/vasp/vasp/IBRION_2.html"><span style=" text-decoration: underline; color:#0000ff;">=2</span></a></li>
  129. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html131"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/IBRION_3.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">I</span></a><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">BRION</span><a href="https://cms.mpi.univie.ac.at/vasp/vasp/IBRION_3.html"><span style=" text-decoration: underline; color:#0000ff;">=3</span></a></li>
  130. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html132"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/IBRION_5_IBRION_6.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">I</span></a><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">BRION</span><a href="https://cms.mpi.univie.ac.at/vasp/vasp/IBRION_5_IBRION_6.html"><span style=" text-decoration: underline; color:#0000ff;">=5 and </span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/IBRION_5_IBRION_6.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">IBRION</span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/IBRION_5_IBRION_6.html"><span style=" text-decoration: underline; color:#0000ff;">=6</span></a></li>
  131. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html133"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/IBRION_7_IBRION_8.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">I</span></a><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">BRION</span><a href="https://cms.mpi.univie.ac.at/vasp/vasp/IBRION_7_IBRION_8.html"><span style=" text-decoration: underline; color:#0000ff;">=7 and </span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/IBRION_7_IBRION_8.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">IBRION</span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/IBRION_7_IBRION_8.html"><span style=" text-decoration: underline; color:#0000ff;">=8</span></a></li>
  132. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html134"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/IBRION_44.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">I</span></a><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">BRION</span><a href="https://cms.mpi.univie.ac.at/vasp/vasp/IBRION_44.html"><span style=" text-decoration: underline; color:#0000ff;">=44</span></a></li>
  133. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html135"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/IBRION_some_general_comments_ISIF_POTIM.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">I</span></a><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">BRION</span><a href="https://cms.mpi.univie.ac.at/vasp/vasp/IBRION_some_general_comments_ISIF_POTIM.html"><span style=" text-decoration: underline; color:#0000ff;"> some general comments (</span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/IBRION_some_general_comments_ISIF_POTIM.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">ISIF</span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/IBRION_some_general_comments_ISIF_POTIM.html"><span style=" text-decoration: underline; color:#0000ff;">, </span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/IBRION_some_general_comments_ISIF_POTIM.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">POTIM</span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/IBRION_some_general_comments_ISIF_POTIM.html"><span style=" text-decoration: underline; color:#0000ff;">)</span></a></li></ul>
  134. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html136"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/POTIM_tag.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">P</span></a><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">OTIM</span><a href="https://cms.mpi.univie.ac.at/vasp/vasp/POTIM_tag.html"><span style=" text-decoration: underline; color:#0000ff;">-tag</span></a></li>
  135. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html137"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/ISIF_tag.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">I</span></a><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">SIF</span><a href="https://cms.mpi.univie.ac.at/vasp/vasp/ISIF_tag.html"><span style=" text-decoration: underline; color:#0000ff;">-tag</span></a></li>
  136. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html138"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/PSTRESS_tag.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">P</span></a><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">STRESS</span><a href="https://cms.mpi.univie.ac.at/vasp/vasp/PSTRESS_tag.html"><span style=" text-decoration: underline; color:#0000ff;">-tag</span></a></li>
  137. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html139"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/IWAVPR_tag.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">I</span></a><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">WAVPR</span><a href="https://cms.mpi.univie.ac.at/vasp/vasp/IWAVPR_tag.html"><span style=" text-decoration: underline; color:#0000ff;">-tag</span></a></li>
  138. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html140"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/ISYM_tag_SYMPREC_tag.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">I</span></a><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">SYM</span><a href="https://cms.mpi.univie.ac.at/vasp/vasp/ISYM_tag_SYMPREC_tag.html"><span style=" text-decoration: underline; color:#0000ff;">-tag and </span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/ISYM_tag_SYMPREC_tag.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">SYMPREC</span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/ISYM_tag_SYMPREC_tag.html"><span style=" text-decoration: underline; color:#0000ff;">-tag</span></a></li>
  139. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html141"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/LCORR_tag.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">L</span></a><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">CORR</span><a href="https://cms.mpi.univie.ac.at/vasp/vasp/LCORR_tag.html"><span style=" text-decoration: underline; color:#0000ff;">-tag</span></a></li>
  140. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html142"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/TEBEG_TEEND_tag.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">T</span></a><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">EBEG</span><a href="https://cms.mpi.univie.ac.at/vasp/vasp/TEBEG_TEEND_tag.html"><span style=" text-decoration: underline; color:#0000ff;"> and </span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/TEBEG_TEEND_tag.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">TEEND</span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/TEBEG_TEEND_tag.html"><span style=" text-decoration: underline; color:#0000ff;">-tag</span></a></li>
  141. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html143"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/SMASS_tag.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">S</span></a><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">MASS</span><a href="https://cms.mpi.univie.ac.at/vasp/vasp/SMASS_tag.html"><span style=" text-decoration: underline; color:#0000ff;">-tag</span></a></li>
  142. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html144"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/NPACO_APACO_tag.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">N</span></a><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">PACO</span><a href="https://cms.mpi.univie.ac.at/vasp/vasp/NPACO_APACO_tag.html"><span style=" text-decoration: underline; color:#0000ff;"> and </span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/NPACO_APACO_tag.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">APACO</span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/NPACO_APACO_tag.html"><span style=" text-decoration: underline; color:#0000ff;">-tag</span></a></li>
  143. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html145"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/POMASS_ZVAL.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">P</span></a><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">OMASS</span><a href="https://cms.mpi.univie.ac.at/vasp/vasp/POMASS_ZVAL.html"><span style=" text-decoration: underline; color:#0000ff;">, </span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/POMASS_ZVAL.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">ZVAL</span></a></li>
  144. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html146"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/RWIGS.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">R</span></a><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">WIGS</span></li>
  145. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html147"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/LORBIT.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">L</span></a><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">ORBIT</span></li>
  146. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html148"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/NELECT.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">N</span></a><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">ELECT</span></li>
  147. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html149"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/NUPDOWN.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">N</span></a><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">UPDOWN</span></li>
  148. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html150"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/EMIN_EMAX_NEDOS_tag.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">E</span></a><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">MIN</span><a href="https://cms.mpi.univie.ac.at/vasp/vasp/EMIN_EMAX_NEDOS_tag.html"><span style=" text-decoration: underline; color:#0000ff;">, </span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/EMIN_EMAX_NEDOS_tag.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">EMAX</span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/EMIN_EMAX_NEDOS_tag.html"><span style=" text-decoration: underline; color:#0000ff;">, </span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/EMIN_EMAX_NEDOS_tag.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">NEDOS</span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/EMIN_EMAX_NEDOS_tag.html"><span style=" text-decoration: underline; color:#0000ff;"> tag</span></a></li>
  149. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html151"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/ISMEAR_SIGMA_FERWE_FERDO_SMEARINGS_tag.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">I</span></a><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">SMEAR</span><a href="https://cms.mpi.univie.ac.at/vasp/vasp/ISMEAR_SIGMA_FERWE_FERDO_SMEARINGS_tag.html"><span style=" text-decoration: underline; color:#0000ff;">, </span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/ISMEAR_SIGMA_FERWE_FERDO_SMEARINGS_tag.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">SIGMA</span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/ISMEAR_SIGMA_FERWE_FERDO_SMEARINGS_tag.html"><span style=" text-decoration: underline; color:#0000ff;">, </span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/ISMEAR_SIGMA_FERWE_FERDO_SMEARINGS_tag.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">FERWE</span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/ISMEAR_SIGMA_FERWE_FERDO_SMEARINGS_tag.html"><span style=" text-decoration: underline; color:#0000ff;">, </span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/ISMEAR_SIGMA_FERWE_FERDO_SMEARINGS_tag.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">FERDO</span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/ISMEAR_SIGMA_FERWE_FERDO_SMEARINGS_tag.html"><span style=" text-decoration: underline; color:#0000ff;"> </span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/ISMEAR_SIGMA_FERWE_FERDO_SMEARINGS_tag.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">SMEARINGS</span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/ISMEAR_SIGMA_FERWE_FERDO_SMEARINGS_tag.html"><span style=" text-decoration: underline; color:#0000ff;"> tag</span></a></li>
  150. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html152"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/LREAL_tag_and_ROPT_tag.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">L</span></a><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">REAL</span><a href="https://cms.mpi.univie.ac.at/vasp/vasp/LREAL_tag_and_ROPT_tag.html"><span style=" text-decoration: underline; color:#0000ff;">-tag (and </span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/LREAL_tag_and_ROPT_tag.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">ROPT</span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/LREAL_tag_and_ROPT_tag.html"><span style=" text-decoration: underline; color:#0000ff;">-tag)</span></a></li>
  151. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html153"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/GGA_tag.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">G</span></a><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">GA</span><a href="https://cms.mpi.univie.ac.at/vasp/vasp/GGA_tag.html"><span style=" text-decoration: underline; color:#0000ff;">-tag</span></a></li>
  152. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html154"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/VOSKOWN_tag.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">V</span></a><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">OSKOWN</span><a href="https://cms.mpi.univie.ac.at/vasp/vasp/VOSKOWN_tag.html"><span style=" text-decoration: underline; color:#0000ff;">-tag</span></a></li>
  153. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html155"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/GGA_COMPAT_tag.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">G</span></a><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">GA_COMPAT</span><a href="https://cms.mpi.univie.ac.at/vasp/vasp/GGA_COMPAT_tag.html"><span style=" text-decoration: underline; color:#0000ff;">-tag</span></a></li>
  154. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html156"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/meta_GGAs.html"><span style=" text-decoration: underline; color:#0000ff;">m</span></a><span style=" text-decoration: underline; color:#0000ff;">eta-GGAs</span></li>
  155. <ul style="margin-top: 0px; margin-bottom: 0px; margin-left: 0px; margin-right: 0px; -qt-list-indent: 3;"><li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html157"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/LMAXTAU.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">L</span></a><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">MAXTAU</span></li>
  156. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html158"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/LMIXTAU.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">L</span></a><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">MIXTAU</span></li></ul>
  157. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html159"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/LASPH_tag.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">L</span></a><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">ASPH</span><a href="https://cms.mpi.univie.ac.at/vasp/vasp/LASPH_tag.html"><span style=" text-decoration: underline; color:#0000ff;">-tag</span></a></li>
  158. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html160"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/DIPOL_tag_VASP_3_2_only.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">D</span></a><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">IPOL</span><a href="https://cms.mpi.univie.ac.at/vasp/vasp/DIPOL_tag_VASP_3_2_only.html"><span style=" text-decoration: underline; color:#0000ff;">-tag (VASP.3.2 only)</span></a></li>
  159. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html161"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/ALGO_tag.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">A</span></a><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">LGO</span><a href="https://cms.mpi.univie.ac.at/vasp/vasp/ALGO_tag.html"><span style=" text-decoration: underline; color:#0000ff;">-tag</span></a></li>
  160. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html162"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/IALGO_LDIAG_tag.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">I</span></a><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">ALGO</span><a href="https://cms.mpi.univie.ac.at/vasp/vasp/IALGO_LDIAG_tag.html"><span style=" text-decoration: underline; color:#0000ff;">, and </span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/IALGO_LDIAG_tag.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">LDIAG</span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/IALGO_LDIAG_tag.html"><span style=" text-decoration: underline; color:#0000ff;">-tag</span></a></li>
  161. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html163"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/NSIM_tag.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">N</span></a><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">SIM</span><a href="https://cms.mpi.univie.ac.at/vasp/vasp/NSIM_tag.html"><span style=" text-decoration: underline; color:#0000ff;"> - tag</span></a></li>
  162. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html164"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Mixing_tags_IMIX_INIMIX_MAXMIX_AMIX_BMIX_AMIX_MAG_BMIX_MAG_AMIN_MIXPRE_WC.html"><span style=" text-decoration: underline; color:#0000ff;">M</span></a><span style=" text-decoration: underline; color:#0000ff;">ixing-tags:</span><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Mixing_tags_IMIX_INIMIX_MAXMIX_AMIX_BMIX_AMIX_MAG_BMIX_MAG_AMIN_MIXPRE_WC.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">IMIX</span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Mixing_tags_IMIX_INIMIX_MAXMIX_AMIX_BMIX_AMIX_MAG_BMIX_MAG_AMIN_MIXPRE_WC.html"><span style=" text-decoration: underline; color:#0000ff;">, </span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Mixing_tags_IMIX_INIMIX_MAXMIX_AMIX_BMIX_AMIX_MAG_BMIX_MAG_AMIN_MIXPRE_WC.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">INIMIX</span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Mixing_tags_IMIX_INIMIX_MAXMIX_AMIX_BMIX_AMIX_MAG_BMIX_MAG_AMIN_MIXPRE_WC.html"><span style=" text-decoration: underline; color:#0000ff;">, </span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Mixing_tags_IMIX_INIMIX_MAXMIX_AMIX_BMIX_AMIX_MAG_BMIX_MAG_AMIN_MIXPRE_WC.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">MAXMIX</span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Mixing_tags_IMIX_INIMIX_MAXMIX_AMIX_BMIX_AMIX_MAG_BMIX_MAG_AMIN_MIXPRE_WC.html"><span style=" text-decoration: underline; color:#0000ff;">, </span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Mixing_tags_IMIX_INIMIX_MAXMIX_AMIX_BMIX_AMIX_MAG_BMIX_MAG_AMIN_MIXPRE_WC.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">AMIX</span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Mixing_tags_IMIX_INIMIX_MAXMIX_AMIX_BMIX_AMIX_MAG_BMIX_MAG_AMIN_MIXPRE_WC.html"><span style=" text-decoration: underline; color:#0000ff;">, </span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Mixing_tags_IMIX_INIMIX_MAXMIX_AMIX_BMIX_AMIX_MAG_BMIX_MAG_AMIN_MIXPRE_WC.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">BMIX</span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Mixing_tags_IMIX_INIMIX_MAXMIX_AMIX_BMIX_AMIX_MAG_BMIX_MAG_AMIN_MIXPRE_WC.html"><span style=" text-decoration: underline; color:#0000ff;">, </span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Mixing_tags_IMIX_INIMIX_MAXMIX_AMIX_BMIX_AMIX_MAG_BMIX_MAG_AMIN_MIXPRE_WC.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">AMIX_MAG</span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Mixing_tags_IMIX_INIMIX_MAXMIX_AMIX_BMIX_AMIX_MAG_BMIX_MAG_AMIN_MIXPRE_WC.html"><span style=" text-decoration: underline; color:#0000ff;">, </span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Mixing_tags_IMIX_INIMIX_MAXMIX_AMIX_BMIX_AMIX_MAG_BMIX_MAG_AMIN_MIXPRE_WC.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">BMIX_MAG</span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Mixing_tags_IMIX_INIMIX_MAXMIX_AMIX_BMIX_AMIX_MAG_BMIX_MAG_AMIN_MIXPRE_WC.html"><span style=" text-decoration: underline; color:#0000ff;">, </span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Mixing_tags_IMIX_INIMIX_MAXMIX_AMIX_BMIX_AMIX_MAG_BMIX_MAG_AMIN_MIXPRE_WC.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">AMIN</span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Mixing_tags_IMIX_INIMIX_MAXMIX_AMIX_BMIX_AMIX_MAG_BMIX_MAG_AMIN_MIXPRE_WC.html"><span style=" text-decoration: underline; color:#0000ff;">, </span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Mixing_tags_IMIX_INIMIX_MAXMIX_AMIX_BMIX_AMIX_MAG_BMIX_MAG_AMIN_MIXPRE_WC.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">MIXPRE</span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Mixing_tags_IMIX_INIMIX_MAXMIX_AMIX_BMIX_AMIX_MAG_BMIX_MAG_AMIN_MIXPRE_WC.html"><span style=" text-decoration: underline; color:#0000ff;">, </span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Mixing_tags_IMIX_INIMIX_MAXMIX_AMIX_BMIX_AMIX_MAG_BMIX_MAG_AMIN_MIXPRE_WC.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">WC</span></a></li>
  163. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html165"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/WEIMIN_EBREAK_DEPER_tags.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">W</span></a><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">EIMIN</span><a href="https://cms.mpi.univie.ac.at/vasp/vasp/WEIMIN_EBREAK_DEPER_tags.html"><span style=" text-decoration: underline; color:#0000ff;">, </span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/WEIMIN_EBREAK_DEPER_tags.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">EBREAK</span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/WEIMIN_EBREAK_DEPER_tags.html"><span style=" text-decoration: underline; color:#0000ff;">, </span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/WEIMIN_EBREAK_DEPER_tags.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">DEPER</span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/WEIMIN_EBREAK_DEPER_tags.html"><span style=" text-decoration: underline; color:#0000ff;"> -tags</span></a></li>
  164. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html166"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/TIME_tag.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">T</span></a><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">IME</span><a href="https://cms.mpi.univie.ac.at/vasp/vasp/TIME_tag.html"><span style=" text-decoration: underline; color:#0000ff;">-tag</span></a></li>
  165. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html167"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/LWAVE_tag_LCHARG_tag.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">L</span></a><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">WAVE</span><a href="https://cms.mpi.univie.ac.at/vasp/vasp/LWAVE_tag_LCHARG_tag.html"><span style=" text-decoration: underline; color:#0000ff;">-tag, </span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/LWAVE_tag_LCHARG_tag.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">LCHARG</span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/LWAVE_tag_LCHARG_tag.html"><span style=" text-decoration: underline; color:#0000ff;">-tag</span></a></li>
  166. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html168"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/LVTOT_tag_core_level_shifts.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">L</span></a><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">VTOT</span><a href="https://cms.mpi.univie.ac.at/vasp/vasp/LVTOT_tag_core_level_shifts.html"><span style=" text-decoration: underline; color:#0000ff;">-tag, and core level shifts</span></a></li>
  167. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html169"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/LVHAR_tag.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">L</span></a><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">VHAR</span><a href="https://cms.mpi.univie.ac.at/vasp/vasp/LVHAR_tag.html"><span style=" text-decoration: underline; color:#0000ff;">-tag</span></a></li>
  168. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html170"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/LELF_tag.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">L</span></a><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">ELF</span><a href="https://cms.mpi.univie.ac.at/vasp/vasp/LELF_tag.html"><span style=" text-decoration: underline; color:#0000ff;">-tag</span></a></li>
  169. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html171"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/ICORELEVEL_tag_core_level_shifts.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">I</span></a><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">CORELEVEL</span><a href="https://cms.mpi.univie.ac.at/vasp/vasp/ICORELEVEL_tag_core_level_shifts.html"><span style=" text-decoration: underline; color:#0000ff;">-tag, and core level shifts</span></a></li>
  170. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html172"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Parallelisation_NPAR_NCORE_LPLANE_KPAR_tag.html"><span style=" text-decoration: underline; color:#0000ff;">P</span></a><span style=" text-decoration: underline; color:#0000ff;">arallelisation:</span><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Parallelisation_NPAR_NCORE_LPLANE_KPAR_tag.html"><span style=" text-decoration: underline; color:#0000ff;"> </span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Parallelisation_NPAR_NCORE_LPLANE_KPAR_tag.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">NPAR</span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Parallelisation_NPAR_NCORE_LPLANE_KPAR_tag.html"><span style=" text-decoration: underline; color:#0000ff;">, </span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Parallelisation_NPAR_NCORE_LPLANE_KPAR_tag.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">NCORE</span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Parallelisation_NPAR_NCORE_LPLANE_KPAR_tag.html"><span style=" text-decoration: underline; color:#0000ff;">, </span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Parallelisation_NPAR_NCORE_LPLANE_KPAR_tag.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">LPLANE</span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Parallelisation_NPAR_NCORE_LPLANE_KPAR_tag.html"><span style=" text-decoration: underline; color:#0000ff;">, and the </span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Parallelisation_NPAR_NCORE_LPLANE_KPAR_tag.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">KPAR</span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Parallelisation_NPAR_NCORE_LPLANE_KPAR_tag.html"><span style=" text-decoration: underline; color:#0000ff;">-tag</span></a></li>
  171. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html173"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/LASYNC_tag.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">L</span></a><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">ASYNC</span><a href="https://cms.mpi.univie.ac.at/vasp/vasp/LASYNC_tag.html"><span style=" text-decoration: underline; color:#0000ff;">-tag</span></a></li>
  172. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html174"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/LscaLAPACK_tag_LscaLU_tag.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">L</span></a><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">scaLAPACK</span><a href="https://cms.mpi.univie.ac.at/vasp/vasp/LscaLAPACK_tag_LscaLU_tag.html"><span style=" text-decoration: underline; color:#0000ff;">-tag and </span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/LscaLAPACK_tag_LscaLU_tag.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">LscaLU</span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/LscaLAPACK_tag_LscaLU_tag.html"><span style=" text-decoration: underline; color:#0000ff;">-tag</span></a></li>
  173. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html175"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Elastic_band_method.html"><span style=" text-decoration: underline; color:#0000ff;">E</span></a><span style=" text-decoration: underline; color:#0000ff;">lastic band method</span></li>
  174. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html176"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Improved_dimer_method.html"><span style=" text-decoration: underline; color:#0000ff;">I</span></a><span style=" text-decoration: underline; color:#0000ff;">mproved dimer method</span></li>
  175. <ul style="margin-top: 0px; margin-bottom: 0px; margin-left: 0px; margin-right: 0px; -qt-list-indent: 3;"><li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html177"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Initial_dimer_axis.html"><span style=" text-decoration: underline; color:#0000ff;">I</span></a><span style=" text-decoration: underline; color:#0000ff;">nitial dimer axis</span></li>
  176. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html178"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Practical_example.html"><span style=" text-decoration: underline; color:#0000ff;">P</span></a><span style=" text-decoration: underline; color:#0000ff;">ractical example</span></li></ul>
  177. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html179"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Advanced_MD_techniques.html"><span style=" text-decoration: underline; color:#0000ff;">A</span></a><span style=" text-decoration: underline; color:#0000ff;">dvanced MD techniques.</span></li>
  178. <ul style="margin-top: 0px; margin-bottom: 0px; margin-left: 0px; margin-right: 0px; -qt-list-indent: 3;"><li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html180"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/brief_overview_simulation_methods.html"><span style=" text-decoration: underline; color:#0000ff;">A</span></a><span style=" text-decoration: underline; color:#0000ff;"> brief overview of simulation methods</span></li>
  179. <ul style="margin-top: 0px; margin-bottom: 0px; margin-left: 0px; margin-right: 0px; -qt-list-indent: 4;"><li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html181"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Biased_molecular_dynamics.html"><span style=" text-decoration: underline; color:#0000ff;">B</span></a><span style=" text-decoration: underline; color:#0000ff;">iased molecular dynamics</span></li>
  180. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html182"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Metadynamics.html"><span style=" text-decoration: underline; color:#0000ff;">M</span></a><span style=" text-decoration: underline; color:#0000ff;">etadynamics</span></li>
  181. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html183"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Constrained_molecular_dynamics.html"><span style=" text-decoration: underline; color:#0000ff;">C</span></a><span style=" text-decoration: underline; color:#0000ff;">onstrained molecular dynamics</span></li>
  182. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html184"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Thermodynamic_integration_free_energy_gradients.html"><span style=" text-decoration: underline; color:#0000ff;">T</span></a><span style=" text-decoration: underline; color:#0000ff;">hermodynamic integration of free-energy gradients</span></li>
  183. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html185"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Slow_growth_approach.html"><span style=" text-decoration: underline; color:#0000ff;">S</span></a><span style=" text-decoration: underline; color:#0000ff;">low-growth approach</span></li></ul>
  184. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html186"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Performing_simulations.html"><span style=" text-decoration: underline; color:#0000ff;">P</span></a><span style=" text-decoration: underline; color:#0000ff;">erforming the simulations</span></li>
  185. <ul style="margin-top: 0px; margin-bottom: 0px; margin-left: 0px; margin-right: 0px; -qt-list-indent: 4;"><li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html187"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Metadynamics_I.html"><span style=" text-decoration: underline; color:#0000ff;">M</span></a><span style=" text-decoration: underline; color:#0000ff;">etadynamics</span></li>
  186. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html188"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Biased_molecular_dynamics_I.html"><span style=" text-decoration: underline; color:#0000ff;">B</span></a><span style=" text-decoration: underline; color:#0000ff;">iased molecular dynamics</span></li>
  187. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html189"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Constrained_molecular_dynamics_I.html"><span style=" text-decoration: underline; color:#0000ff;">C</span></a><span style=" text-decoration: underline; color:#0000ff;">onstrained molecular dynamics</span></li>
  188. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html190"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Slow_growth_simulation.html"><span style=" text-decoration: underline; color:#0000ff;">S</span></a><span style=" text-decoration: underline; color:#0000ff;">low-growth simulation</span></li>
  189. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html191"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Monitoring_geometric_parameters_in_molecular_dynamics.html"><span style=" text-decoration: underline; color:#0000ff;">M</span></a><span style=" text-decoration: underline; color:#0000ff;">onitoring geometric parameters in molecular dynamics</span></li>
  190. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html192"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Langevin_dynamics_in_NVT_ensemble.html"><span style=" text-decoration: underline; color:#0000ff;">L</span></a><span style=" text-decoration: underline; color:#0000ff;">angevin dynamics in NVT ensemble</span></li>
  191. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html193"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Parrinello_Rahman_NpT_dynamics_with_Langevin_thermostat.html"><span style=" text-decoration: underline; color:#0000ff;">P</span></a><span style=" text-decoration: underline; color:#0000ff;">arrinello-Rahman (NpT) dynamics with Langevin thermostat</span></li>
  192. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html194"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Stochastic_boundary_conditions.html"><span style=" text-decoration: underline; color:#0000ff;">S</span></a><span style=" text-decoration: underline; color:#0000ff;">tochastic boundary conditions</span></li>
  193. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html195"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Practical_example_I.html"><span style=" text-decoration: underline; color:#0000ff;">P</span></a><span style=" text-decoration: underline; color:#0000ff;">ractical example</span></li></ul>
  194. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html196"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/INCAR_tags.html"><span style=" text-decoration: underline; color:#0000ff;">I</span></a><span style=" text-decoration: underline; color:#0000ff;">NCAR tags</span></li>
  195. <ul style="margin-top: 0px; margin-bottom: 0px; margin-left: 0px; margin-right: 0px; -qt-list-indent: 4;"><li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html197"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/MDALGO.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">M</span></a><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">DALGO</span></li>
  196. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html198"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/ANDERSEN_PROB.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">A</span></a><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">NDERSEN_PROB</span></li>
  197. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html199"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/RANDOM_SEED.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">R</span></a><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">ANDOM_SEED</span></li>
  198. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html200"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/LBLUEOUT.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">L</span></a><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">BLUEOUT</span></li>
  199. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html201"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/SHAKETOL_SHAKEMAXITER.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">S</span></a><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">HAKETOL</span><a href="https://cms.mpi.univie.ac.at/vasp/vasp/SHAKETOL_SHAKEMAXITER.html"><span style=" text-decoration: underline; color:#0000ff;"> and </span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/SHAKETOL_SHAKEMAXITER.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">SHAKEMAXITER</span></a></li>
  200. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html202"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/HILLS_H_HILLS_W_HILLS_BIN.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">H</span></a><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">ILLS_H</span><a href="https://cms.mpi.univie.ac.at/vasp/vasp/HILLS_H_HILLS_W_HILLS_BIN.html"><span style=" text-decoration: underline; color:#0000ff;">, </span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/HILLS_H_HILLS_W_HILLS_BIN.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">HILLS_W</span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/HILLS_H_HILLS_W_HILLS_BIN.html"><span style=" text-decoration: underline; color:#0000ff;">, and </span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/HILLS_H_HILLS_W_HILLS_BIN.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">HILLS_BIN</span></a></li>
  201. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html203"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/INCREM.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">I</span></a><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">NCREM</span></li>
  202. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html204"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/VALUE_MIN_VALUE_MAX.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">V</span></a><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">ALUE_MIN</span><a href="https://cms.mpi.univie.ac.at/vasp/vasp/VALUE_MIN_VALUE_MAX.html"><span style=" text-decoration: underline; color:#0000ff;"> and </span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/VALUE_MIN_VALUE_MAX.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">VALUE_MAX</span></a></li>
  203. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html205"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/LANGEVIN_GAMMA_LANGEVIN_GAMMA_L.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">L</span></a><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">ANGEVIN_GAMMA</span><a href="https://cms.mpi.univie.ac.at/vasp/vasp/LANGEVIN_GAMMA_LANGEVIN_GAMMA_L.html"><span style=" text-decoration: underline; color:#0000ff;"> and </span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/LANGEVIN_GAMMA_LANGEVIN_GAMMA_L.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">LANGEVIN_GAMMA_L</span></a></li>
  204. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html206"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/PMASS.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">P</span></a><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">MASS</span></li></ul>
  205. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html207"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Important_files.html"><span style=" text-decoration: underline; color:#0000ff;">I</span></a><span style=" text-decoration: underline; color:#0000ff;">mportant files</span></li>
  206. <ul style="margin-top: 0px; margin-bottom: 0px; margin-left: 0px; margin-right: 0px; -qt-list-indent: 4;"><li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html208"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/ICONST.html"><span style=" text-decoration: underline; color:#0000ff;">I</span></a><span style=" text-decoration: underline; color:#0000ff;">CONST</span></li>
  207. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html209"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/PENALTYPOT.html"><span style=" text-decoration: underline; color:#0000ff;">P</span></a><span style=" text-decoration: underline; color:#0000ff;">ENALTYPOT</span></li>
  208. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html210"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/HILLSPOT.html"><span style=" text-decoration: underline; color:#0000ff;">H</span></a><span style=" text-decoration: underline; color:#0000ff;">ILLSPOT</span></li>
  209. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html211"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/REPORT.html"><span style=" text-decoration: underline; color:#0000ff;">R</span></a><span style=" text-decoration: underline; color:#0000ff;">EPORT</span></li></ul>
  210. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html212"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Additional_thermostats.html"><span style=" text-decoration: underline; color:#0000ff;">A</span></a><span style=" text-decoration: underline; color:#0000ff;">dditional thermostats</span></li>
  211. <ul style="margin-top: 0px; margin-bottom: 0px; margin-left: 0px; margin-right: 0px; -qt-list-indent: 4;"><li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html213"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Andersen_thermostat.html"><span style=" text-decoration: underline; color:#0000ff;">A</span></a><span style=" text-decoration: underline; color:#0000ff;">ndersen thermostat</span></li>
  212. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html214"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Multiple_Andersen_thermostats.html"><span style=" text-decoration: underline; color:#0000ff;">M</span></a><span style=" text-decoration: underline; color:#0000ff;">ultiple Andersen thermostats</span></li>
  213. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html215"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Langevin_thermostat.html"><span style=" text-decoration: underline; color:#0000ff;">L</span></a><span style=" text-decoration: underline; color:#0000ff;">angevin thermostat</span></li>
  214. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html216"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Stochastic_boundary_conditions_I.html"><span style=" text-decoration: underline; color:#0000ff;">S</span></a><span style=" text-decoration: underline; color:#0000ff;">tochastic boundary conditions</span></li></ul>
  215. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html217"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Parrinello_Rahman_dynamics.html"><span style=" text-decoration: underline; color:#0000ff;">P</span></a><span style=" text-decoration: underline; color:#0000ff;">arrinello-Rahman dynamics</span></li></ul>
  216. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html218"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/PAW_control_tags.html"><span style=" text-decoration: underline; color:#0000ff;">P</span></a><span style=" text-decoration: underline; color:#0000ff;">AW control tags</span></li>
  217. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html219"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Monopole_Dipole_Quadrupole_corrections_NELECT_IDIPOL_DIPOL_LMONO_LDIPOL_EPSILON.html"><span style=" text-decoration: underline; color:#0000ff;">M</span></a><span style=" text-decoration: underline; color:#0000ff;">onopole, Dipole and Quadrupole corrections:</span><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Monopole_Dipole_Quadrupole_corrections_NELECT_IDIPOL_DIPOL_LMONO_LDIPOL_EPSILON.html"><span style=" text-decoration: underline; color:#0000ff;"> </span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Monopole_Dipole_Quadrupole_corrections_NELECT_IDIPOL_DIPOL_LMONO_LDIPOL_EPSILON.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">NELECT</span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Monopole_Dipole_Quadrupole_corrections_NELECT_IDIPOL_DIPOL_LMONO_LDIPOL_EPSILON.html"><span style=" text-decoration: underline; color:#0000ff;">, </span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Monopole_Dipole_Quadrupole_corrections_NELECT_IDIPOL_DIPOL_LMONO_LDIPOL_EPSILON.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">IDIPOL</span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Monopole_Dipole_Quadrupole_corrections_NELECT_IDIPOL_DIPOL_LMONO_LDIPOL_EPSILON.html"><span style=" text-decoration: underline; color:#0000ff;">, </span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Monopole_Dipole_Quadrupole_corrections_NELECT_IDIPOL_DIPOL_LMONO_LDIPOL_EPSILON.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">DIPOL</span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Monopole_Dipole_Quadrupole_corrections_NELECT_IDIPOL_DIPOL_LMONO_LDIPOL_EPSILON.html"><span style=" text-decoration: underline; color:#0000ff;">, </span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Monopole_Dipole_Quadrupole_corrections_NELECT_IDIPOL_DIPOL_LMONO_LDIPOL_EPSILON.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">LMONO</span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Monopole_Dipole_Quadrupole_corrections_NELECT_IDIPOL_DIPOL_LMONO_LDIPOL_EPSILON.html"><span style=" text-decoration: underline; color:#0000ff;">, </span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Monopole_Dipole_Quadrupole_corrections_NELECT_IDIPOL_DIPOL_LMONO_LDIPOL_EPSILON.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">LDIPOL</span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Monopole_Dipole_Quadrupole_corrections_NELECT_IDIPOL_DIPOL_LMONO_LDIPOL_EPSILON.html"><span style=" text-decoration: underline; color:#0000ff;">, </span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Monopole_Dipole_Quadrupole_corrections_NELECT_IDIPOL_DIPOL_LMONO_LDIPOL_EPSILON.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">EPSILON</span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Monopole_Dipole_Quadrupole_corrections_NELECT_IDIPOL_DIPOL_LMONO_LDIPOL_EPSILON.html"><span style=" text-decoration: underline; color:#0000ff;"> and </span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Monopole_Dipole_Quadrupole_corrections_NELECT_IDIPOL_DIPOL_LMONO_LDIPOL_EPSILON.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">EFIELD</span></a></li>
  218. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html220"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Dipole_corrections_defects_in_solids.html"><span style=" text-decoration: underline; color:#0000ff;">D</span></a><span style=" text-decoration: underline; color:#0000ff;">ipole corrections for defects in solids</span></li>
  219. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html221"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Band_decomposed_chargedensity_parameters.html"><span style=" text-decoration: underline; color:#0000ff;">B</span></a><span style=" text-decoration: underline; color:#0000ff;">and decomposed chargedensity (</span><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Band_decomposed_chargedensity_parameters.html"><span style=" font-style:italic; text-decoration: underline; color:#0000ff;">parameters</span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Band_decomposed_chargedensity_parameters.html"><span style=" text-decoration: underline; color:#0000ff;">)</span></a></li>
  220. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html222"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Berry_phase_calculations_finite_electric_fields.html"><span style=" text-decoration: underline; color:#0000ff;">B</span></a><span style=" text-decoration: underline; color:#0000ff;">erry phase calculations and finite electric fields</span></li>
  221. <ul style="margin-top: 0px; margin-bottom: 0px; margin-left: 0px; margin-right: 0px; -qt-list-indent: 3;"><li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html223"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/LBERRY_IGPAR_NPPSTR_DIPOL_tags.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">L</span></a><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">BERRY</span><a href="https://cms.mpi.univie.ac.at/vasp/vasp/LBERRY_IGPAR_NPPSTR_DIPOL_tags.html"><span style=" text-decoration: underline; color:#0000ff;">, </span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/LBERRY_IGPAR_NPPSTR_DIPOL_tags.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">IGPAR</span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/LBERRY_IGPAR_NPPSTR_DIPOL_tags.html"><span style=" text-decoration: underline; color:#0000ff;">, </span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/LBERRY_IGPAR_NPPSTR_DIPOL_tags.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">NPPSTR</span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/LBERRY_IGPAR_NPPSTR_DIPOL_tags.html"><span style=" text-decoration: underline; color:#0000ff;">, </span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/LBERRY_IGPAR_NPPSTR_DIPOL_tags.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">DIPOL</span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/LBERRY_IGPAR_NPPSTR_DIPOL_tags.html"><span style=" text-decoration: underline; color:#0000ff;"> tags</span></a></li>
  222. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html224"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/LCALCPOL_tag_Macroscopic_polarization_again.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">L</span></a><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">CALCPOL</span><a href="https://cms.mpi.univie.ac.at/vasp/vasp/LCALCPOL_tag_Macroscopic_polarization_again.html"><span style=" text-decoration: underline; color:#0000ff;">-tag: Macroscopic polarization (again)</span></a></li>
  223. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html225"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/EFIELD_PEAD_tag_Finite_electric_fields.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">E</span></a><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">FIELD_PEAD</span><a href="https://cms.mpi.univie.ac.at/vasp/vasp/EFIELD_PEAD_tag_Finite_electric_fields.html"><span style=" text-decoration: underline; color:#0000ff;">-tag: Finite electric fields</span></a></li>
  224. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html226"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/LCALCEPS_tag_Macroscopic_dielectric_properties_Born_effective_charge_tensors.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">L</span></a><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">CALCEPS</span><a href="https://cms.mpi.univie.ac.at/vasp/vasp/LCALCEPS_tag_Macroscopic_dielectric_properties_Born_effective_charge_tensors.html"><span style=" text-decoration: underline; color:#0000ff;">-tag: Macroscopic dielectric properties and Born effective charge tensors</span></a></li>
  225. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html227"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/LPEAD_tag_IPEAD_tag_Derivative_orbitals_w_r_t_k_point.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">L</span></a><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">PEAD</span><a href="https://cms.mpi.univie.ac.at/vasp/vasp/LPEAD_tag_IPEAD_tag_Derivative_orbitals_w_r_t_k_point.html"><span style=" text-decoration: underline; color:#0000ff;">-tag and </span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/LPEAD_tag_IPEAD_tag_Derivative_orbitals_w_r_t_k_point.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">IPEAD</span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/LPEAD_tag_IPEAD_tag_Derivative_orbitals_w_r_t_k_point.html"><span style=" text-decoration: underline; color:#0000ff;">-tag: Derivative of the orbitals w.r.t. the k-point</span></a></li></ul>
  226. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html228"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Non_collinear_calculations_spin_orbit_coupling.html"><span style=" text-decoration: underline; color:#0000ff;">N</span></a><span style=" text-decoration: underline; color:#0000ff;">on-collinear calculations and spin orbit coupling</span></li>
  227. <ul style="margin-top: 0px; margin-bottom: 0px; margin-left: 0px; margin-right: 0px; -qt-list-indent: 3;"><li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html229"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/LNONCOLLINEAR_tag.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">L</span></a><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">NONCOLLINEAR</span><a href="https://cms.mpi.univie.ac.at/vasp/vasp/LNONCOLLINEAR_tag.html"><span style=" text-decoration: underline; color:#0000ff;">-tag</span></a></li>
  228. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html230"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/LSORBIT_tag.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">L</span></a><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">SORBIT</span><a href="https://cms.mpi.univie.ac.at/vasp/vasp/LSORBIT_tag.html"><span style=" text-decoration: underline; color:#0000ff;">-tag</span></a></li></ul>
  229. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html231"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Constraining_direction_magnetic_moments.html"><span style=" text-decoration: underline; color:#0000ff;">C</span></a><span style=" text-decoration: underline; color:#0000ff;">onstraining the direction of magnetic moments</span></li>
  230. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html232"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/On_site_Coulomb_interaction_L_S_DA_U.html"><span style=" text-decoration: underline; color:#0000ff;">O</span></a><span style=" text-decoration: underline; color:#0000ff;">n site Coulomb interaction: L(S)DA+U</span></li>
  231. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html233"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Hartree_Fock_HF_type_hybrid_functional_calculations.html"><span style=" text-decoration: underline; color:#0000ff;">H</span></a><span style=" text-decoration: underline; color:#0000ff;">artree-Fock (HF) type and hybrid functional calculations</span></li>
  232. <ul style="margin-top: 0px; margin-bottom: 0px; margin-left: 0px; margin-right: 0px; -qt-list-indent: 3;"><li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html234"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Introduction_Hartree_Fock.html"><span style=" text-decoration: underline; color:#0000ff;">I</span></a><span style=" text-decoration: underline; color:#0000ff;">ntroduction: Hartree-Fock</span></li>
  233. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html235"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/LHFCALC_tag.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">L</span></a><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">HFCALC</span><a href="https://cms.mpi.univie.ac.at/vasp/vasp/LHFCALC_tag.html"><span style=" text-decoration: underline; color:#0000ff;">-tag</span></a></li>
  234. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html236"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Amount_exact_DFT_exchange_correlation_AEXX_AGGAX_AGGAC_ALDAC_tags.html"><span style=" text-decoration: underline; color:#0000ff;">A</span></a><span style=" text-decoration: underline; color:#0000ff;">mount of exact/DFT exchange and correlation:</span><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Amount_exact_DFT_exchange_correlation_AEXX_AGGAX_AGGAC_ALDAC_tags.html"><span style=" text-decoration: underline; color:#0000ff;"> </span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Amount_exact_DFT_exchange_correlation_AEXX_AGGAX_AGGAC_ALDAC_tags.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">AEXX</span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Amount_exact_DFT_exchange_correlation_AEXX_AGGAX_AGGAC_ALDAC_tags.html"><span style=" text-decoration: underline; color:#0000ff;">, </span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Amount_exact_DFT_exchange_correlation_AEXX_AGGAX_AGGAC_ALDAC_tags.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">AGGAX</span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Amount_exact_DFT_exchange_correlation_AEXX_AGGAX_AGGAC_ALDAC_tags.html"><span style=" text-decoration: underline; color:#0000ff;">, </span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Amount_exact_DFT_exchange_correlation_AEXX_AGGAX_AGGAC_ALDAC_tags.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">AGGAC</span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Amount_exact_DFT_exchange_correlation_AEXX_AGGAX_AGGAC_ALDAC_tags.html"><span style=" text-decoration: underline; color:#0000ff;"> and </span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Amount_exact_DFT_exchange_correlation_AEXX_AGGAX_AGGAC_ALDAC_tags.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">ALDAC</span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Amount_exact_DFT_exchange_correlation_AEXX_AGGAX_AGGAC_ALDAC_tags.html"><span style=" text-decoration: underline; color:#0000ff;"> tags </span></a></li>
  235. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html237"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/ENCUTFOCK_FFT_grid_in_Hartree_Fock_related_routines.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">E</span></a><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">NCUTFOCK</span><a href="https://cms.mpi.univie.ac.at/vasp/vasp/ENCUTFOCK_FFT_grid_in_Hartree_Fock_related_routines.html"><span style=" text-decoration: underline; color:#0000ff;">: FFT grid in the Hartree-Fock related routines</span></a></li>
  236. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html238"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/PRECFOCK_FFT_grid_in_Hartree_Fock_GW_related_routines.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">P</span></a><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">RECFOCK</span><a href="https://cms.mpi.univie.ac.at/vasp/vasp/PRECFOCK_FFT_grid_in_Hartree_Fock_GW_related_routines.html"><span style=" text-decoration: underline; color:#0000ff;">: FFT grid in the Hartree-Fock and GW related routines</span></a></li>
  237. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html239"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/LMAXFOCK_or_old_HFLMAXF.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">L</span></a><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">MAXFOCK</span><a href="https://cms.mpi.univie.ac.at/vasp/vasp/LMAXFOCK_or_old_HFLMAXF.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;"> </span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/LMAXFOCK_or_old_HFLMAXF.html"><span style=" text-decoration: underline; color:#0000ff;">(or old </span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/LMAXFOCK_or_old_HFLMAXF.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">HFLMAXF </span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/LMAXFOCK_or_old_HFLMAXF.html"><span style=" text-decoration: underline; color:#0000ff;">)</span></a></li>
  238. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html240"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/LMAXFOCKAE.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">L</span></a><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">MAXFOCKAE</span></li>
  239. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html241"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/HFSCREEN_LTHOMAS.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">H</span></a><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">FSCREEN</span><a href="https://cms.mpi.univie.ac.at/vasp/vasp/HFSCREEN_LTHOMAS.html"><span style=" text-decoration: underline; color:#0000ff;"> and </span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/HFSCREEN_LTHOMAS.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">LTHOMAS</span></a></li>
  240. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html242"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/NKRED_NKREDX_NKREDY_NKREDZ_EVENONLY_ODDONLY.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">N</span></a><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">KRED</span><a href="https://cms.mpi.univie.ac.at/vasp/vasp/NKRED_NKREDX_NKREDY_NKREDZ_EVENONLY_ODDONLY.html"><span style=" text-decoration: underline; color:#0000ff;">, </span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/NKRED_NKREDX_NKREDY_NKREDZ_EVENONLY_ODDONLY.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">NKREDX</span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/NKRED_NKREDX_NKREDY_NKREDZ_EVENONLY_ODDONLY.html"><span style=" text-decoration: underline; color:#0000ff;">, </span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/NKRED_NKREDX_NKREDY_NKREDZ_EVENONLY_ODDONLY.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">NKREDY</span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/NKRED_NKREDX_NKREDY_NKREDZ_EVENONLY_ODDONLY.html"><span style=" text-decoration: underline; color:#0000ff;">, </span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/NKRED_NKREDX_NKREDY_NKREDZ_EVENONLY_ODDONLY.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">NKREDZ</span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/NKRED_NKREDX_NKREDY_NKREDZ_EVENONLY_ODDONLY.html"><span style=" text-decoration: underline; color:#0000ff;"> and </span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/NKRED_NKREDX_NKREDY_NKREDZ_EVENONLY_ODDONLY.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">EVENONLY</span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/NKRED_NKREDX_NKREDY_NKREDZ_EVENONLY_ODDONLY.html"><span style=" text-decoration: underline; color:#0000ff;">, </span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/NKRED_NKREDX_NKREDY_NKREDZ_EVENONLY_ODDONLY.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">ODDONLY</span></a></li>
  241. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html243"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/When_NKRED_should_not_be_applied.html"><span style=" text-decoration: underline; color:#0000ff;">W</span></a><span style=" text-decoration: underline; color:#0000ff;">hen</span><a href="https://cms.mpi.univie.ac.at/vasp/vasp/When_NKRED_should_not_be_applied.html"><span style=" text-decoration: underline; color:#0000ff;"> </span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/When_NKRED_should_not_be_applied.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">NKRED</span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/When_NKRED_should_not_be_applied.html"><span style=" text-decoration: underline; color:#0000ff;"> should not be applied</span></a></li>
  242. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html244"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Typical_hybrid_functional_Hartree_Fock_calculations.html"><span style=" text-decoration: underline; color:#0000ff;">T</span></a><span style=" text-decoration: underline; color:#0000ff;">ypical hybrid functional and Hartree-Fock calculations</span></li></ul>
  243. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html245"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Optical_properties_density_functional_perturbation_theory_PT.html"><span style=" text-decoration: underline; color:#0000ff;">O</span></a><span style=" text-decoration: underline; color:#0000ff;">ptical properties and density functional perturbation theory (PT)</span></li>
  244. <ul style="margin-top: 0px; margin-bottom: 0px; margin-left: 0px; margin-right: 0px; -qt-list-indent: 3;"><li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html246"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/LOPTICS_frequency_dependent_dielectric_matrix.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">L</span></a><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">OPTICS</span><a href="https://cms.mpi.univie.ac.at/vasp/vasp/LOPTICS_frequency_dependent_dielectric_matrix.html"><span style=" text-decoration: underline; color:#0000ff;">: frequency dependent dielectric matrix</span></a></li>
  245. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html247"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/CSHIFT_complex_shift_in_Kramers_Kronig_transformation.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">C</span></a><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">SHIFT</span><a href="https://cms.mpi.univie.ac.at/vasp/vasp/CSHIFT_complex_shift_in_Kramers_Kronig_transformation.html"><span style=" text-decoration: underline; color:#0000ff;">: complex shift in Kramers-Kronig transformation</span></a></li>
  246. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html248"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/LNABLA_transversal_gauge.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">L</span></a><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">NABLA</span><a href="https://cms.mpi.univie.ac.at/vasp/vasp/LNABLA_transversal_gauge.html"><span style=" text-decoration: underline; color:#0000ff;">: transversal gauge</span></a></li>
  247. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html249"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/LEPSILON_static_dielectric_matrix_ion_clamped_piezoelectric_tensor_Born_effective_charges.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">L</span></a><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">EPSILON</span><a href="https://cms.mpi.univie.ac.at/vasp/vasp/LEPSILON_static_dielectric_matrix_ion_clamped_piezoelectric_tensor_Born_effective_charges.html"><span style=" text-decoration: underline; color:#0000ff;">: static dielectric matrix, ion-clamped piezoelectric tensor and the Born effective charges using density functional perturbation theory</span></a></li>
  248. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html250"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/LRPA_local_field_effects_on_Hartree_level_RPA.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">L</span></a><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">RPA</span><a href="https://cms.mpi.univie.ac.at/vasp/vasp/LRPA_local_field_effects_on_Hartree_level_RPA.html"><span style=" text-decoration: underline; color:#0000ff;">: local field effects on the Hartree level (RPA)</span></a></li>
  249. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html251"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Vibrational_frequencies_relaxed_ion_static_dielectric_tensor_relaxed_ion_piezoelectric_tensor.html"><span style=" text-decoration: underline; color:#0000ff;">V</span></a><span style=" text-decoration: underline; color:#0000ff;">ibrational frequencies, relaxed-ion static dielectric tensor and relaxed-ion piezoelectric tensor</span></li></ul>
  250. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html252"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Frequency_dependent_GW_calculations.html"><span style=" text-decoration: underline; color:#0000ff;">F</span></a><span style=" text-decoration: underline; color:#0000ff;">requency dependent GW calculations</span></li>
  251. <ul style="margin-top: 0px; margin-bottom: 0px; margin-left: 0px; margin-right: 0px; -qt-list-indent: 3;"><li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html253"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/ALGO_response_functions_GW_calculations.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">A</span></a><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">LGO</span><a href="https://cms.mpi.univie.ac.at/vasp/vasp/ALGO_response_functions_GW_calculations.html"><span style=" text-decoration: underline; color:#0000ff;"> for response functions and GW calculations</span></a></li>
  252. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html254"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/LMAXFOCKAE_I.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">L</span></a><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">MAXFOCKAE</span><a href="https://cms.mpi.univie.ac.at/vasp/vasp/LMAXFOCKAE_I.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;"> </span></a></li>
  253. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html255"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/NOMEGA_NOMEGAR_number_frequency_points.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">N</span></a><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">OMEGA</span><a href="https://cms.mpi.univie.ac.at/vasp/vasp/NOMEGA_NOMEGAR_number_frequency_points.html"><span style=" text-decoration: underline; color:#0000ff;">, </span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/NOMEGA_NOMEGAR_number_frequency_points.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">NOMEGAR</span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/NOMEGA_NOMEGAR_number_frequency_points.html"><span style=" text-decoration: underline; color:#0000ff;"> number of frequency points</span></a></li>
  254. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html256"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/LSPECTRAL_use_spectral_method.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">L</span></a><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">SPECTRAL</span><a href="https://cms.mpi.univie.ac.at/vasp/vasp/LSPECTRAL_use_spectral_method.html"><span style=" text-decoration: underline; color:#0000ff;">: use the spectral method</span></a></li>
  255. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html257"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/OMEGAMIN_OMEGAMAX_OMEGATL_CSHIFT.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">O</span></a><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">MEGAMIN</span><a href="https://cms.mpi.univie.ac.at/vasp/vasp/OMEGAMIN_OMEGAMAX_OMEGATL_CSHIFT.html"><span style=" text-decoration: underline; color:#0000ff;">, </span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/OMEGAMIN_OMEGAMAX_OMEGATL_CSHIFT.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">OMEGAMAX</span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/OMEGAMIN_OMEGAMAX_OMEGATL_CSHIFT.html"><span style=" text-decoration: underline; color:#0000ff;">, </span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/OMEGAMIN_OMEGAMAX_OMEGATL_CSHIFT.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">OMEGATL</span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/OMEGAMIN_OMEGAMAX_OMEGATL_CSHIFT.html"><span style=" text-decoration: underline; color:#0000ff;"> and </span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/OMEGAMIN_OMEGAMAX_OMEGATL_CSHIFT.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">CSHIFT</span></a></li>
  256. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html258"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/NBANDSGW_Number_orbitals_updated_in_GW.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">N</span></a><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">BANDSGW</span><a href="https://cms.mpi.univie.ac.at/vasp/vasp/NBANDSGW_Number_orbitals_updated_in_GW.html"><span style=" text-decoration: underline; color:#0000ff;"> Number of orbitals updated in GW</span></a></li>
  257. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html259"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/ENCUTGW_energy_cutoff_response_function.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">E</span></a><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">NCUTGW</span><a href="https://cms.mpi.univie.ac.at/vasp/vasp/ENCUTGW_energy_cutoff_response_function.html"><span style=" text-decoration: underline; color:#0000ff;"> energy cutoff for response function</span></a></li>
  258. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html260"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/ENCUTGWSOFT_soft_cutoff_Coulomb_kernel.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">E</span></a><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">NCUTGWSOFT</span><a href="https://cms.mpi.univie.ac.at/vasp/vasp/ENCUTGWSOFT_soft_cutoff_Coulomb_kernel.html"><span style=" text-decoration: underline; color:#0000ff;"> soft cutoff for Coulomb kernel</span></a></li>
  259. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html261"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/ODDONLYGW_EVENONLYGW_NKRED_reducing_grid_response_functions.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">O</span></a><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">DDONLYGW</span><a href="https://cms.mpi.univie.ac.at/vasp/vasp/ODDONLYGW_EVENONLYGW_NKRED_reducing_grid_response_functions.html"><span style=" text-decoration: underline; color:#0000ff;"> and </span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/ODDONLYGW_EVENONLYGW_NKRED_reducing_grid_response_functions.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">EVENONLYGW</span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/ODDONLYGW_EVENONLYGW_NKRED_reducing_grid_response_functions.html"><span style=" text-decoration: underline; color:#0000ff;"> and </span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/ODDONLYGW_EVENONLYGW_NKRED_reducing_grid_response_functions.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">NKRED</span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/ODDONLYGW_EVENONLYGW_NKRED_reducing_grid_response_functions.html"><span style=" text-decoration: underline; color:#0000ff;">: reducing the </span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/ODDONLYGW_EVENONLYGW_NKRED_reducing_grid_response_functions.html"><img src="https://cms.mpi.univie.ac.at/vasp/vasp/img2.png" width="16" height="18" /></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/ODDONLYGW_EVENONLYGW_NKRED_reducing_grid_response_functions.html"><span style=" text-decoration: underline; color:#0000ff;">-grid for the response functions</span></a></li>
  260. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html262"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/LSELFENERGY_frequency_dependent_self_energy.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">L</span></a><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">SELFENERGY</span><a href="https://cms.mpi.univie.ac.at/vasp/vasp/LSELFENERGY_frequency_dependent_self_energy.html"><span style=" text-decoration: underline; color:#0000ff;">: the frequency dependent self energy </span></a></li>
  261. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html263"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/LWAVE_selfconsistent_GW.html"><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">L</span></a><span style=" font-family:'Monaco'; text-decoration: underline; color:#0000ff;">WAVE</span><a href="https://cms.mpi.univie.ac.at/vasp/vasp/LWAVE_selfconsistent_GW.html"><span style=" text-decoration: underline; color:#0000ff;">: selfconsistent GW </span></a></li>
  262. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html264"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Recipe_GW_calculations.html"><span style=" text-decoration: underline; color:#0000ff;">R</span></a><span style=" text-decoration: underline; color:#0000ff;">ecipe for G</span><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Recipe_GW_calculations.html"><img src="https://cms.mpi.univie.ac.at/vasp/vasp/img3.png" width="14" height="34" style="vertical-align: middle;" /></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Recipe_GW_calculations.html"><span style=" text-decoration: underline; color:#0000ff;">W</span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Recipe_GW_calculations.html"><img src="https://cms.mpi.univie.ac.at/vasp/vasp/img3.png" width="14" height="34" style="vertical-align: middle;" /></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Recipe_GW_calculations.html"><span style=" text-decoration: underline; color:#0000ff;"> calculations</span></a></li>
  263. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html265"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Recipe_partially_selfconsistent_GW_calculations.html"><span style=" text-decoration: underline; color:#0000ff;">R</span></a><span style=" text-decoration: underline; color:#0000ff;">ecipe for partially selfconsistent GW</span><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Recipe_partially_selfconsistent_GW_calculations.html"><img src="https://cms.mpi.univie.ac.at/vasp/vasp/img3.png" width="14" height="34" style="vertical-align: middle;" /></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Recipe_partially_selfconsistent_GW_calculations.html"><span style=" text-decoration: underline; color:#0000ff;"> calculations</span></a></li>
  264. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html266"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Recipe_selfconsistent_GW_calculations.html"><span style=" text-decoration: underline; color:#0000ff;">R</span></a><span style=" text-decoration: underline; color:#0000ff;">ecipe for selfconsistent GW calculations</span></li>
  265. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html267"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Caveats_selfconsistent_quasiparticle_GW_calculations.html"><span style=" text-decoration: underline; color:#0000ff;">C</span></a><span style=" text-decoration: underline; color:#0000ff;">aveats for selfconsistent quasiparticle GW calculations</span></li>
  266. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html268"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Using_GW_routines_determination_frequency_dependent_dielectric_matrix.html"><span style=" text-decoration: underline; color:#0000ff;">U</span></a><span style=" text-decoration: underline; color:#0000ff;">sing the GW routines for the determination of frequency dependent dielectric matrix</span></li>
  267. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html269"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/scGW0_caveats.html"><span style=" text-decoration: underline; color:#0000ff;">s</span></a><span style=" text-decoration: underline; color:#0000ff;">cGW0 caveats</span></li></ul>
  268. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html270"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/BSE_Bethe_Salpeter_calculations.html"><span style=" text-decoration: underline; color:#0000ff;">B</span></a><span style=" text-decoration: underline; color:#0000ff;">SE Bethe-Salpeter calculations</span></li>
  269. <ul style="margin-top: 0px; margin-bottom: 0px; margin-left: 0px; margin-right: 0px; -qt-list-indent: 3;"><li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html271"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/NBANDSO_NBANDSV.html"><span style=" text-decoration: underline; color:#0000ff;">N</span></a><span style=" text-decoration: underline; color:#0000ff;">BANDSO and NBANDSV</span><a href="https://cms.mpi.univie.ac.at/vasp/vasp/NBANDSO_NBANDSV.html"><span style=" text-decoration: underline; color:#0000ff;"> </span></a></li>
  270. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html272"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/OMEGAMAX.html"><span style=" text-decoration: underline; color:#0000ff;">O</span></a><span style=" text-decoration: underline; color:#0000ff;">MEGAMAX</span><a href="https://cms.mpi.univie.ac.at/vasp/vasp/OMEGAMAX.html"><span style=" text-decoration: underline; color:#0000ff;"> </span></a></li>
  271. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html273"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/ANTIRES.html"><span style=" text-decoration: underline; color:#0000ff;">A</span></a><span style=" text-decoration: underline; color:#0000ff;">NTIRES</span><a href="https://cms.mpi.univie.ac.at/vasp/vasp/ANTIRES.html"><span style=" text-decoration: underline; color:#0000ff;"> </span></a></li>
  272. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html274"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/LHARTREE_LADDER.html"><span style=" text-decoration: underline; color:#0000ff;">L</span></a><span style=" text-decoration: underline; color:#0000ff;">HARTREE, LADDER</span><a href="https://cms.mpi.univie.ac.at/vasp/vasp/LHARTREE_LADDER.html"><span style=" text-decoration: underline; color:#0000ff;"> </span></a></li>
  273. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html275"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/KPOINT_BSE.html"><span style=" text-decoration: underline; color:#0000ff;">K</span></a><span style=" text-decoration: underline; color:#0000ff;">POINT_BSE</span><a href="https://cms.mpi.univie.ac.at/vasp/vasp/KPOINT_BSE.html"><span style=" text-decoration: underline; color:#0000ff;"> </span></a></li></ul>
  274. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html276"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/ACFDT_RPA_total_energies.html"><span style=" text-decoration: underline; color:#0000ff;">A</span></a><span style=" text-decoration: underline; color:#0000ff;">CFDT-RPA total energies</span></li>
  275. <ul style="margin-top: 0px; margin-bottom: 0px; margin-left: 0px; margin-right: 0px; -qt-list-indent: 3;"><li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html277"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/general_recipe_calculate_ACFDT_RPA_total_energies.html"><span style=" text-decoration: underline; color:#0000ff;">A</span></a><span style=" text-decoration: underline; color:#0000ff;"> general recipe to calculate ACFDT-RPA total energies</span></li>
  276. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html278"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Possible_tests_known_issues.html"><span style=" text-decoration: underline; color:#0000ff;">P</span></a><span style=" text-decoration: underline; color:#0000ff;">ossible tests and known issues</span></li></ul>
  277. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html279"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/MP2_calculations.html"><span style=" text-decoration: underline; color:#0000ff;">M</span></a><span style=" text-decoration: underline; color:#0000ff;">P2 calculations</span></li>
  278. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html280"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/IVDW_approximate_vdW_correction_methods.html"><span style=" text-decoration: underline; color:#0000ff;">I</span></a><span style=" text-decoration: underline; color:#0000ff;">VDW, approximate vdW correction methods</span></li>
  279. <ul style="margin-top: 0px; margin-bottom: 0px; margin-left: 0px; margin-right: 0px; -qt-list-indent: 3;"><li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html281"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/DFT_D2_method.html"><span style=" text-decoration: underline; color:#0000ff;">D</span></a><span style=" text-decoration: underline; color:#0000ff;">FT-D2 method</span></li>
  280. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html282"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/DFT_D3_method.html"><span style=" text-decoration: underline; color:#0000ff;">D</span></a><span style=" text-decoration: underline; color:#0000ff;">FT-D3 method</span></li>
  281. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html283"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Tkatchenko_Scheffler_method.html"><span style=" text-decoration: underline; color:#0000ff;">T</span></a><span style=" text-decoration: underline; color:#0000ff;">katchenko-Scheffler method</span></li>
  282. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html284"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Tkatchenko_Scheffler_method_with_iterative_Hirshfeld_partitioning.html"><span style=" text-decoration: underline; color:#0000ff;">T</span></a><span style=" text-decoration: underline; color:#0000ff;">katchenko-Scheffler method with iterative Hirshfeld partitioning</span></li>
  283. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html285"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Self_consistent_screening_in_Tkatchenko_Scheffler_method.html"><span style=" text-decoration: underline; color:#0000ff;">S</span></a><span style=" text-decoration: underline; color:#0000ff;">elf-consistent screening in Tkatchenko-Scheffler method</span></li>
  284. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html286"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Many_body_dispersion_energy_method.html"><span style=" text-decoration: underline; color:#0000ff;">M</span></a><span style=" text-decoration: underline; color:#0000ff;">any-body dispersion energy method</span></li>
  285. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html287"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/dDsC_dispersion_correction.html"><span style=" text-decoration: underline; color:#0000ff;">d</span></a><span style=" text-decoration: underline; color:#0000ff;">DsC dispersion correction</span></li></ul>
  286. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html288"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/vdW_DF_functional_Langreth_Lundqvist_et_al.html"><span style=" text-decoration: underline; color:#0000ff;">v</span></a><span style=" text-decoration: underline; color:#0000ff;">dW-DF functional of Langreth and Lundqvist et al.</span></li>
  287. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html289"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Electric_Field_Gradients.html"><span style=" text-decoration: underline; color:#0000ff;">E</span></a><span style=" text-decoration: underline; color:#0000ff;">lectric Field Gradients</span></li>
  288. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html290"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Hyperfine_Parameters.html"><span style=" text-decoration: underline; color:#0000ff;">H</span></a><span style=" text-decoration: underline; color:#0000ff;">yperfine Parameters</span></li>
  289. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html291"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Chemical_Shifts.html"><span style=" text-decoration: underline; color:#0000ff;">C</span></a><span style=" text-decoration: underline; color:#0000ff;">hemical Shifts</span></li>
  290. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html292"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/k_point_projection_scheme.html"><span style=" text-decoration: underline; color:#0000ff;">k</span></a><span style=" text-decoration: underline; color:#0000ff;">-point projection scheme</span></li>
  291. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html293"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Interface_pinning.html"><span style=" text-decoration: underline; color:#0000ff;">I</span></a><span style=" text-decoration: underline; color:#0000ff;">nterface pinning</span></li>
  292. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html294"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Not_enough_memory_what_do.html"><span style=" text-decoration: underline; color:#0000ff;">N</span></a><span style=" text-decoration: underline; color:#0000ff;">ot enough memory, what to do</span></li></ul>
  293. <p style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:1; text-indent:0px;"><span style=" font-family:'-webkit-standard'; color:#000000;"><br /></span></p>
  294. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html295"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Theoretical_Background.html"><span style=" text-decoration: underline; color:#0000ff;">T</span></a><span style=" text-decoration: underline; color:#0000ff;">heoretical Background</span></li>
  295. <ul style="margin-top: 0px; margin-bottom: 0px; margin-left: 0px; margin-right: 0px; -qt-list-indent: 2;"><li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html296"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Algorithms_used_in_VASP_calculate_electronic_groundstate.html"><span style=" text-decoration: underline; color:#0000ff;">A</span></a><span style=" text-decoration: underline; color:#0000ff;">lgorithms used in VASP to calculate the electronic groundstate</span></li>
  296. <ul style="margin-top: 0px; margin-bottom: 0px; margin-left: 0px; margin-right: 0px; -qt-list-indent: 3;"><li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html297"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Preconditioning.html"><span style=" text-decoration: underline; color:#0000ff;">P</span></a><span style=" text-decoration: underline; color:#0000ff;">reconditioning</span></li>
  297. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html298"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Simple_Davidson_iteration_scheme.html"><span style=" text-decoration: underline; color:#0000ff;">S</span></a><span style=" text-decoration: underline; color:#0000ff;">imple Davidson iteration scheme</span></li>
  298. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html299"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Single_band_steepest_descent_scheme.html"><span style=" text-decoration: underline; color:#0000ff;">S</span></a><span style=" text-decoration: underline; color:#0000ff;">ingle band, steepest descent scheme</span></li>
  299. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html300"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Efficient_single_band_eigenvalue_minimization.html"><span style=" text-decoration: underline; color:#0000ff;">E</span></a><span style=" text-decoration: underline; color:#0000ff;">fficient single band eigenvalue-minimization</span></li>
  300. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html301"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Conjugate_gradient_optimization.html"><span style=" text-decoration: underline; color:#0000ff;">C</span></a><span style=" text-decoration: underline; color:#0000ff;">onjugate gradient optimization</span></li>
  301. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html302"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Implemented_Davidson_block_iteration_scheme.html"><span style=" text-decoration: underline; color:#0000ff;">I</span></a><span style=" text-decoration: underline; color:#0000ff;">mplemented Davidson-block iteration scheme</span></li>
  302. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html303"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Residual_minimization_scheme_direct_inversion_in_iterative_subspace_RMM_DIIS.html"><span style=" text-decoration: underline; color:#0000ff;">R</span></a><span style=" text-decoration: underline; color:#0000ff;">esidual minimization scheme, direct inversion in the iterative subspace (RMM-DIIS)</span></li></ul>
  303. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html304"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Wrap_around_errors_convolutions.html"><span style=" text-decoration: underline; color:#0000ff;">W</span></a><span style=" text-decoration: underline; color:#0000ff;">rap-around errors -- convolutions</span></li>
  304. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html305"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Non_selfconsistent_Harris_Foulkes_functional.html"><span style=" text-decoration: underline; color:#0000ff;">N</span></a><span style=" text-decoration: underline; color:#0000ff;">on-selfconsistent Harris-Foulkes functional</span></li>
  305. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html306"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Partial_occupancies_different_methods.html"><span style=" text-decoration: underline; color:#0000ff;">P</span></a><span style=" text-decoration: underline; color:#0000ff;">artial occupancies, different methods</span></li>
  306. <ul style="margin-top: 0px; margin-bottom: 0px; margin-left: 0px; margin-right: 0px; -qt-list-indent: 3;"><li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html307"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Linear_tetrahedron_method.html"><span style=" text-decoration: underline; color:#0000ff;">L</span></a><span style=" text-decoration: underline; color:#0000ff;">inear tetrahedron method</span></li>
  307. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html308"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Finite_temperature_approaches_smearing_methods.html"><span style=" text-decoration: underline; color:#0000ff;">F</span></a><span style=" text-decoration: underline; color:#0000ff;">inite temperature approaches -- smearing methods</span></li>
  308. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html309"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Improved_functional_form_method_Methfessel_Paxton.html"><span style=" text-decoration: underline; color:#0000ff;">I</span></a><span style=" text-decoration: underline; color:#0000ff;">mproved functional form for</span><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Improved_functional_form_method_Methfessel_Paxton.html"><span style=" text-decoration: underline; color:#0000ff;"> </span></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Improved_functional_form_method_Methfessel_Paxton.html"><img src="https://cms.mpi.univie.ac.at/vasp/vasp/img11.png" width="17" height="36" style="vertical-align: middle;" /></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Improved_functional_form_method_Methfessel_Paxton.html"><span style=" text-decoration: underline; color:#0000ff;"> -- method of Methfessel and Paxton</span></a></li></ul>
  309. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html310"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Forces.html"><span style=" text-decoration: underline; color:#0000ff;">F</span></a><span style=" text-decoration: underline; color:#0000ff;">orces</span></li>
  310. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html311"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Volume_vs_energy_volume_relaxations_Pulay_Stress.html"><span style=" text-decoration: underline; color:#0000ff;">V</span></a><span style=" text-decoration: underline; color:#0000ff;">olume vs. energy, volume relaxations, Pulay Stress</span></li></ul>
  311. <ul style="margin-top: 0px; margin-bottom: 0px; margin-left: 0px; margin-right: 0px; -qt-list-indent: 3;"><li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html312"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/How_calculate_Pulay_stress.html"><span style=" text-decoration: underline; color:#0000ff;">H</span></a><span style=" text-decoration: underline; color:#0000ff;">ow to calculate the Pulay stress</span></li>
  312. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html313"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Accurate_bulk_relaxations_with_internal_parameters_one.html"><span style=" text-decoration: underline; color:#0000ff;">A</span></a><span style=" text-decoration: underline; color:#0000ff;">ccurate bulk relaxations with internal parameters (one)</span></li>
  313. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html314"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Accurate_bulk_relaxations_with_internal_parameters_two.html"><span style=" text-decoration: underline; color:#0000ff;">A</span></a><span style=" text-decoration: underline; color:#0000ff;">ccurate bulk relaxations with internal parameters (two)</span></li>
  314. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html315"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/FAQ_Why_is_my_energy_vs_volume_plot_jagged.html"><span style=" text-decoration: underline; color:#0000ff;">F</span></a><span style=" text-decoration: underline; color:#0000ff;">AQ: Why is my energy vs. volume plot jagged</span></li></ul>
  315. <p style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:1; text-indent:0px;"><span style=" font-family:'-webkit-standard'; color:#000000;"><br /></span></p>
  316. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html316"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/most_important_parameters_source_errors.html"><span style=" text-decoration: underline; color:#0000ff;">T</span></a><span style=" text-decoration: underline; color:#0000ff;">he most important parameters, source of errors</span></li>
  317. <ul style="margin-top: 0px; margin-bottom: 0px; margin-left: 0px; margin-right: 0px; -qt-list-indent: 2;"><li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html317"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Number_bands_NBANDS.html"><span style=" text-decoration: underline; color:#0000ff;">N</span></a><span style=" text-decoration: underline; color:#0000ff;">umber of bands NBANDS</span></li>
  318. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html318"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/High_quality_quantitative_versus_qualitative_calculations.html"><span style=" text-decoration: underline; color:#0000ff;">H</span></a><span style=" text-decoration: underline; color:#0000ff;">igh quality quantitative versus qualitative calculations</span></li>
  319. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html319"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/What_kind_technical_errors_do_exist_overview.html"><span style=" text-decoration: underline; color:#0000ff;">W</span></a><span style=" text-decoration: underline; color:#0000ff;">hat kind of ``technical'' errors do exist, overview</span></li>
  320. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html320"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Energy_cut_off_ENCUT_FFT_mesh.html"><span style=" text-decoration: underline; color:#0000ff;">E</span></a><span style=" text-decoration: underline; color:#0000ff;">nergy cut-off ENCUT, and FFT-mesh</span></li>
  321. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html321"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/When_set_ENCUT_and_ENAUG_hand.html"><span style=" text-decoration: underline; color:#0000ff;">W</span></a><span style=" text-decoration: underline; color:#0000ff;">hen to set ENCUT (and ENAUG) by hand</span></li>
  322. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html322"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Number_k_points_method_smearing.html"><span style=" text-decoration: underline; color:#0000ff;">N</span></a><span style=" text-decoration: underline; color:#0000ff;">umber of k-points, and method for smearing</span></li></ul>
  323. <p style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:1; text-indent:0px;"><span style=" font-family:'-webkit-standard'; color:#000000;"><br /></span></p>
  324. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html323"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Examples.html"><span style=" text-decoration: underline; color:#0000ff;">E</span></a><span style=" text-decoration: underline; color:#0000ff;">xamples</span></li>
  325. <ul style="margin-top: 0px; margin-bottom: 0px; margin-left: 0px; margin-right: 0px; -qt-list-indent: 2;"><li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html324"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Simple_bulk_calculations.html"><span style=" text-decoration: underline; color:#0000ff;">S</span></a><span style=" text-decoration: underline; color:#0000ff;">imple bulk calculations</span></li>
  326. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html325"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Bulk_calculations_with_internal_parameters.html"><span style=" text-decoration: underline; color:#0000ff;">B</span></a><span style=" text-decoration: underline; color:#0000ff;">ulk calculations with internal parameters</span></li>
  327. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html326"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Accurate_DOS_Band_structure_calculations.html"><span style=" text-decoration: underline; color:#0000ff;">A</span></a><span style=" text-decoration: underline; color:#0000ff;">ccurate DOS and Band-structure calculations</span></li>
  328. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html327"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Atoms.html"><span style=" text-decoration: underline; color:#0000ff;">A</span></a><span style=" text-decoration: underline; color:#0000ff;">toms</span></li>
  329. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html328"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Determining_groundstate_energ_atoms.html"><span style=" text-decoration: underline; color:#0000ff;">D</span></a><span style=" text-decoration: underline; color:#0000ff;">etermining the groundstate energ of atoms</span></li>
  330. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html329"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Dimers.html"><span style=" text-decoration: underline; color:#0000ff;">D</span></a><span style=" text-decoration: underline; color:#0000ff;">imers</span></li>
  331. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html330"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Molecular_Dynamics.html"><span style=" text-decoration: underline; color:#0000ff;">M</span></a><span style=" text-decoration: underline; color:#0000ff;">olecular -- Dynamics</span></li>
  332. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html331"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Simulated_annealing.html"><span style=" text-decoration: underline; color:#0000ff;">S</span></a><span style=" text-decoration: underline; color:#0000ff;">imulated annealing</span></li>
  333. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html332"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Lattice_dynamics_via_force_constant_approach.html"><span style=" text-decoration: underline; color:#0000ff;">L</span></a><span style=" text-decoration: underline; color:#0000ff;">attice dynamics, via the force constant approach</span></li></ul>
  334. <p style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:1; text-indent:0px;"><span style=" font-family:'-webkit-standard'; color:#000000;"><br /></span></p>
  335. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html333"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Pseudopotentials_PAW_potentials_supplied_with_VASP_package.html"><span style=" text-decoration: underline; color:#0000ff;">P</span></a><span style=" text-decoration: underline; color:#0000ff;">seudopotentials and PAW potentials supplied with the VASP package</span></li>
  336. <ul style="margin-top: 0px; margin-bottom: 0px; margin-left: 0px; margin-right: 0px; -qt-list-indent: 2;"><li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html334"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Ultrasoft_pseudopotentials_supplied_with_VASP_package.html"><span style=" text-decoration: underline; color:#0000ff;">U</span></a><span style=" text-decoration: underline; color:#0000ff;">ltrasoft pseudopotentials supplied with the VASP package</span></li>
  337. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html335"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/PAW_potentials.html"><span style=" text-decoration: underline; color:#0000ff;">T</span></a><span style=" text-decoration: underline; color:#0000ff;">he PAW potentials</span></li></ul>
  338. <ul style="margin-top: 0px; margin-bottom: 0px; margin-left: 0px; margin-right: 0px; -qt-list-indent: 3;"><li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html336"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Recommended_PAW_potentials_DFT_calculations_using_vasp_5_2.html"><span style=" text-decoration: underline; color:#0000ff;">R</span></a><span style=" text-decoration: underline; color:#0000ff;">ecommended PAW potentials for DFT calculations using vasp.5.2</span></li>
  339. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html337"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Recommended_GW_PAW_potentials_vasp_5_2.html"><span style=" text-decoration: underline; color:#0000ff;">R</span></a><span style=" text-decoration: underline; color:#0000ff;">ecommended GW PAW potentials for vasp.5.2</span></li>
  340. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html338"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/st_row_elements.html"><span style=" text-decoration: underline; color:#0000ff;">1</span></a><span style=" text-decoration: underline; color:#0000ff;">st row elements</span></li>
  341. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html339"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Alkali_alkali_earth_elements_simple_metals.html"><span style=" text-decoration: underline; color:#0000ff;">A</span></a><span style=" text-decoration: underline; color:#0000ff;">lkali and alkali-earth elements (simple metals)</span></li>
  342. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a href="https://cms.mpi.univie.ac.at/vasp/vasp/_elements.html"><img src="https://cms.mpi.univie.ac.at/vasp/vasp/img12.png" width="15" height="18" /></a><a name="tex2html340"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/_elements.html"><span style=" text-decoration: underline; color:#0000ff;">-</span></a><span style=" text-decoration: underline; color:#0000ff;">elements</span></li>
  343. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a href="https://cms.mpi.univie.ac.at/vasp/vasp/_elements_including_first_row.html"><img src="https://cms.mpi.univie.ac.at/vasp/vasp/img13.png" width="15" height="34" style="vertical-align: middle;" /></a><a name="tex2html341"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/_elements_including_first_row.html"><span style=" text-decoration: underline; color:#0000ff;">-</span></a><span style=" text-decoration: underline; color:#0000ff;">elements, including first row</span></li>
  344. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a href="https://cms.mpi.univie.ac.at/vasp/vasp/_elements_I.html"><img src="https://cms.mpi.univie.ac.at/vasp/vasp/img11.png" width="17" height="36" style="vertical-align: middle;" /></a><a name="tex2html342"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/_elements_I.html"><span style=" text-decoration: underline; color:#0000ff;">-</span></a><span style=" text-decoration: underline; color:#0000ff;">elements</span></li></ul>
  345. <p style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:1; text-indent:0px;"><span style=" font-family:'-webkit-standard'; color:#000000;"><br /></span></p>
  346. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html343"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/pseudopotential_generation_package.html"><span style=" text-decoration: underline; color:#0000ff;">T</span></a><span style=" text-decoration: underline; color:#0000ff;">he pseudopotential generation package</span></li>
  347. <ul style="margin-top: 0px; margin-bottom: 0px; margin-left: 0px; margin-right: 0px; -qt-list-indent: 2;"><li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html344"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/V_RHFIN_V_RHFOUT_V_TABIN_V_TABOUT_file.html"><span style=" text-decoration: underline; color:#0000ff;">V</span></a><span style=" text-decoration: underline; color:#0000ff;">_RHFIN, V_RHFOUT V_TABIN AND V_TABOUT file</span></li>
  348. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html345"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/PSCTR.html"><span style=" text-decoration: underline; color:#0000ff;">P</span></a><span style=" text-decoration: underline; color:#0000ff;">SCTR</span></li>
  349. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html346"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Default_energy_cutoff.html"><span style=" text-decoration: underline; color:#0000ff;">D</span></a><span style=" text-decoration: underline; color:#0000ff;">efault energy cutoff</span></li>
  350. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html347"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/TAGS_rhfsps_program.html"><span style=" text-decoration: underline; color:#0000ff;">T</span></a><span style=" text-decoration: underline; color:#0000ff;">AGS for the rhfsps program</span></li>
  351. <ul style="margin-top: 0px; margin-bottom: 0px; margin-left: 0px; margin-right: 0px; -qt-list-indent: 3;"><li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html348"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/TITEL_tag.html"><span style=" text-decoration: underline; color:#0000ff;">T</span></a><span style=" text-decoration: underline; color:#0000ff;">ITEL-tag</span></li>
  352. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html349"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/NWRITE_tag_I.html"><span style=" text-decoration: underline; color:#0000ff;">N</span></a><span style=" text-decoration: underline; color:#0000ff;">WRITE-tag</span></li>
  353. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html350"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/LULTRA_tag.html"><span style=" text-decoration: underline; color:#0000ff;">L</span></a><span style=" text-decoration: underline; color:#0000ff;">ULTRA-tag</span></li>
  354. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html351"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/RPACOR_tag.html"><span style=" text-decoration: underline; color:#0000ff;">R</span></a><span style=" text-decoration: underline; color:#0000ff;">PACOR-tag</span></li>
  355. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html352"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/IUNSCR_tag.html"><span style=" text-decoration: underline; color:#0000ff;">I</span></a><span style=" text-decoration: underline; color:#0000ff;">UNSCR-tag</span></li>
  356. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html353"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/RCUT_tag.html"><span style=" text-decoration: underline; color:#0000ff;">R</span></a><span style=" text-decoration: underline; color:#0000ff;">CUT-tag</span></li>
  357. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html354"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/RCORE_tag.html"><span style=" text-decoration: underline; color:#0000ff;">R</span></a><span style=" text-decoration: underline; color:#0000ff;">CORE-tag</span></li>
  358. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html355"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/RWIGS_tag.html"><span style=" text-decoration: underline; color:#0000ff;">R</span></a><span style=" text-decoration: underline; color:#0000ff;">WIGS-tag</span></li>
  359. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html356"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/XLAMBDA_XM_HOCHN_tags.html"><span style=" text-decoration: underline; color:#0000ff;">X</span></a><span style=" text-decoration: underline; color:#0000ff;">LAMBDA, XM, HOCHN -tags</span></li>
  360. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html357"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/QRYD_LCONT_NMAX1_NMAX2_parameters.html"><span style=" text-decoration: underline; color:#0000ff;">Q</span></a><span style=" text-decoration: underline; color:#0000ff;">RYD, LCONT, NMAX1, NMAX2 parameters</span></li>
  361. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html358"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Description_section_PSCTR_file.html"><span style=" text-decoration: underline; color:#0000ff;">D</span></a><span style=" text-decoration: underline; color:#0000ff;">escription section of the PSCTR file</span></li></ul>
  362. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html359"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/TAGS_fourpot3_program.html"><span style=" text-decoration: underline; color:#0000ff;">T</span></a><span style=" text-decoration: underline; color:#0000ff;">AGS for the fourpot3 program</span></li>
  363. <ul style="margin-top: 0px; margin-bottom: 0px; margin-left: 0px; margin-right: 0px; -qt-list-indent: 3;"><li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html360"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/ICORE_RCLOC_tags.html"><span style=" text-decoration: underline; color:#0000ff;">I</span></a><span style=" text-decoration: underline; color:#0000ff;">CORE, RCLOC tags</span></li>
  364. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html361"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/MD_NFFT_tags.html"><span style=" text-decoration: underline; color:#0000ff;">M</span></a><span style=" text-decoration: underline; color:#0000ff;">D, NFFT tags</span></li>
  365. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html362"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/NQL_DELQL_tags.html"><span style=" text-decoration: underline; color:#0000ff;">N</span></a><span style=" text-decoration: underline; color:#0000ff;">QL, DELQL tags</span></li>
  366. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html363"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/NQNL_NQNNL_DELQNL_tags.html"><span style=" text-decoration: underline; color:#0000ff;">N</span></a><span style=" text-decoration: underline; color:#0000ff;">QNL, NQNNL, DELQNL tags</span></li>
  367. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html364"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/RWIGS_NE_EFORM_ETO_tags.html"><span style=" text-decoration: underline; color:#0000ff;">R</span></a><span style=" text-decoration: underline; color:#0000ff;">WIGS, NE, EFORM, ETO tags</span></li>
  368. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html365"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/RMAX_RDEP_QCUT_QGAM_tags.html"><span style=" text-decoration: underline; color:#0000ff;">R</span></a><span style=" text-decoration: underline; color:#0000ff;">MAX, RDEP, QCUT, QGAM tags</span></li></ul>
  369. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html366"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/PSOUT_file.html"><span style=" text-decoration: underline; color:#0000ff;">P</span></a><span style=" text-decoration: underline; color:#0000ff;">SOUT file</span></li>
  370. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html367"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/FOUROUT_file.html"><span style=" text-decoration: underline; color:#0000ff;">F</span></a><span style=" text-decoration: underline; color:#0000ff;">OUROUT file</span></li>
  371. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html368"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/DDE_file.html"><span style=" text-decoration: underline; color:#0000ff;">D</span></a><span style=" text-decoration: underline; color:#0000ff;">DE file</span></li></ul>
  372. <p style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:1; text-indent:0px;"><span style=" font-family:'-webkit-standard'; color:#000000;"><br /></span></p>
  373. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html369"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/General_recommendations_PSCTR_files.html"><span style=" text-decoration: underline; color:#0000ff;">G</span></a><span style=" text-decoration: underline; color:#0000ff;">eneral recommendations for the PSCTR files</span></li>
  374. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html370"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Example_PSCTR_files.html"><span style=" text-decoration: underline; color:#0000ff;">E</span></a><span style=" text-decoration: underline; color:#0000ff;">xample PSCTR files</span></li>
  375. <ul style="margin-top: 0px; margin-bottom: 0px; margin-left: 0px; margin-right: 0px; -qt-list-indent: 2;"><li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html371"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Potassium_pseudopotential.html"><span style=" text-decoration: underline; color:#0000ff;">P</span></a><span style=" text-decoration: underline; color:#0000ff;">otassium pseudopotential</span></li>
  376. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html372"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Vanadium_pseudopotential.html"><span style=" text-decoration: underline; color:#0000ff;">V</span></a><span style=" text-decoration: underline; color:#0000ff;">anadium pseudopotential</span></li>
  377. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html373"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Palladium_pseudopotential.html"><span style=" text-decoration: underline; color:#0000ff;">P</span></a><span style=" text-decoration: underline; color:#0000ff;">alladium pseudopotential</span></li>
  378. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html374"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Carbon_pseudopotential.html"><span style=" text-decoration: underline; color:#0000ff;">C</span></a><span style=" text-decoration: underline; color:#0000ff;">arbon pseudopotential</span></li>
  379. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html375"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Hydrogen_pseudopotential.html"><span style=" text-decoration: underline; color:#0000ff;">H</span></a><span style=" text-decoration: underline; color:#0000ff;">ydrogen pseudopotential</span></li>
  380. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html376"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Some_guidelines_create_transition_metal_PP.html"><span style=" text-decoration: underline; color:#0000ff;">S</span></a><span style=" text-decoration: underline; color:#0000ff;">ome guidelines to create transition metal PP</span></li></ul>
  381. <p style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:1; text-indent:0px;"><span style=" font-family:'-webkit-standard'; color:#000000;"><br /></span></p>
  382. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html377"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Important_hints_programmers.html"><span style=" text-decoration: underline; color:#0000ff;">I</span></a><span style=" text-decoration: underline; color:#0000ff;">mportant hints for programmers</span></li>
  383. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html378"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/FAQ.html"><span style=" text-decoration: underline; color:#0000ff;">F</span></a><span style=" text-decoration: underline; color:#0000ff;">AQ</span></li>
  384. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html379"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Bibliography.html"><span style=" text-decoration: underline; color:#0000ff;">B</span></a><span style=" text-decoration: underline; color:#0000ff;">ibliography</span></li>
  385. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html380"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/Index.html"><span style=" text-decoration: underline; color:#0000ff;">I</span></a><span style=" text-decoration: underline; color:#0000ff;">ndex</span></li>
  386. <li style=" font-family:'-webkit-standard'; color:#000000;" style=" margin-top:0px; margin-bottom:12px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><a name="tex2html381"></a><a href="https://cms.mpi.univie.ac.at/vasp/vasp/About_this_document.html"><span style=" text-decoration: underline; color:#0000ff;">A</span></a><span style=" text-decoration: underline; color:#0000ff;">bout this document ...</span></li></ul>
  387. <p style=" margin-top:0px; margin-bottom:0px; margin-left:0px; margin-right:0px; -qt-block-indent:0; text-indent:0px;"><br /></p></body></html>
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