vasp 
  6.2.1  
  16May21 (build Apr 11 2022 11:03:26) complex                          parallel 
  Lin64 
  2024 09 01 
  18:23:45 
 
 
  No title
       0
  Normal
  Normal (blocked Davidson)
   F  
       2
       2
       1
     200
       2
      -1
        0.00001000
       -0.02000000
       0
       2
       1
      400.00000000
        1.11000000      0.32000000      0.73000000
  Auto
       1
        0.20000000
       1
   F  
   F  
       1
 
 
  
   
    
            7.66310000       0.00000000       0.00000000 
            0.00000000      19.66310000       0.00000000 
            0.00000000       0.00000000      10.83726000 
    
       1632.96160543 
    
            0.13049549       0.00000000       0.00000000 
            0.00000000       0.05085668       0.00000000 
            0.00000000       0.00000000       0.09227425 
    
   
   
           0.92728754       0.52637589       0.10690300 
           0.84993344       0.23325044       0.42775095 
           0.13776045       0.44811204       0.19361350 
           0.09235258       0.28266713       0.33322158 
           0.81927432       0.33113341       0.02700435 
           0.95506732       0.42054833       0.51724270 
           0.08231250       0.33302705       0.13764340 
           0.19748341       0.40734169       0.38879181 
           0.83015144       0.54499216       0.52722290 
           0.77205255       0.24304065       0.88132999 
           0.06313267       0.50862459       0.65288086 
           0.01336636       0.20527430       0.75855278 
           0.90255149       0.30956240       0.59371915 
           0.86386150       0.44192838       0.95521600 
           0.14009623       0.32336575       0.73649625 
           0.09914047       0.43389162       0.82002448 
           0.42263919       0.46259122       0.12074399 
           0.36176559       0.28796294       0.42237527 
           0.68986121       0.48168329       0.20789001 
           0.63872799       0.31227270       0.34276398 
           0.32474499       0.31626732       0.01109161 
           0.43360725       0.43907317       0.52004240 
           0.56245405       0.34455057       0.14179412 
           0.69110553       0.43029503       0.40156594 
           0.31669118       0.55288103       0.54931953 
           0.27231272       0.23132761       0.86406146 
           0.60007226       0.51804988       0.66243960 
           0.53728269       0.20802975       0.75329707 
           0.39552833       0.32943557       0.62088705 
           0.36754886       0.42540300       0.92202527 
           0.66652385       0.32453952       0.72499518 
           0.62888509       0.43396332       0.81697374 
           0.65730676       0.70993485       0.62227001 
           0.68206911       0.72451309       0.55905294 
           0.46050937       0.58276243       0.67068933 
   
  
  
           1 
           2 
           3 
           4 
           5 
           6 
           7 
           8 
           9 
          10 
          11 
          12 
          13 
          14 
          15 
          16 
          17 
          18 
          19 
          20 
          21 
          22 
          23 
          24 
          25 
          26 
          27 
          28 
          29 
          30 
          31 
          32 
          33 
          34 
          35 
  
 
 
  
          2        1        2 
         0.00000000       0.00000000       0.00000000 
         0.50000000       0.00000000       0.00000000 
         0.00000000       1.00000000       0.00000000 
         0.00000000       0.00000000       0.50000000 
         0.00000000       0.00000000       0.00000000 
  
  
          0.00000000       0.00000000       0.00000000 
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          0.00000000       0.00000000       0.50000000 
          0.50000000       0.00000000       0.50000000 
  
  
          0.25000000 
          0.25000000 
          0.25000000 
          0.25000000 
  
 
 
  
   No title
    F  
  
  
   normal
       400.00000000
       605.39200000
         0.00001000
       38
       10
      105
       -1
       -1
       136.00000000
        0
        0
        0
        0
         0.00000000
   
         1
          0.20000000
          0.50000000
     T  
     T  
   
   
     T  
         -0.00050000     -0.00050000     -0.00050000
      -100
         2
     F  
   
   
         0
         2
         1
   
   
         2
     F  
          1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000
      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000
         -1.00000000
     F  
          0.00000000      0.00000000      1.00000000
     F  
          0.00000000      0.00000000      0.00000000
     F  
   
   
     F  
     F  
   
   
       200
        -5
         2
        400.00000000
    
      T  
      F  
           0.00000000
           0.00000002
           0.30000000
          4
           0.40000000
    
   
   
          0.40000000
          1.00000000
          0.10000000
          1.60000000
          1.00000000
    
          4
      F  
        -45
         100.00000000
          1
          1
          5
    
   
   
     F  
     F  
         0
          1.00000000
       -100.00000000   -100.00000000   -100.00000000
          0.00000000
   
  
  
       40
       96
       54
       80
      192
      108
    F  
  
  
        0
       -1
        0
        2
         0.00000000
        -0.02000000
        0
         0.50000000
        -3.00000000
         1.00000000
  
  
         0.00010000
         0.00010000
        1
        1
      256
        16.00000000
  
  
        2
         0.00001000
  
  
        0
         1.11000000      0.32000000      0.73000000
      301
        10.00000000
       -10.00000000
         0.00000000
  
  
        1
    F  
    F  
    F  
    F  
    F  
    F  
    F  
    F  
         0.00000000      0.00000000      0.00000000      0.00000000      0.00000000      0.00000000      0.00000000
  
  
        3
        4
       -1
    T  
    F  
    F  
    F  
    F  
    F  
  
  
        3
       -1
    F  
        28.08500000      1.00000000     16.00000000
         0.00000000      0.00000000      0.00000000
         1.00000000      1.00000000      1.00000000
    T  
  
   T  
   F  
       0
   F  
       0
  
   --
        1
    F  
   
    F  
    F  
    F  
    F  
    F  
        -1.00000000
        0
        0
         0.00000000
         0.00000000
         0.00000000
         1.00000000
         1.00000000
         1.00000000
         1.00000000
        1
        1
        1
    F  
    F  
    F  
        0
        0
    F  
         0.00000000
         0.00000000
        0
  
  
    F  
        -0.84910000
         0.12340000
         1.00000000
         0.00000000
  
  
        0
        27.99362752
         1.00000000
  
  
    F  
    F  
    F  
    F  
        0
         0.10000000
        -1.00000000
         0.00200000
        -0.10000000
         0.00000000
         0.00000000      0.00000000      0.00000000
         0.00000000      0.00000000      0.00000000      0.00000000      0.00000000      0.00000000      0.00000000      0.00000000      0.00000000
  
  
    F  
         0.00000000      0.00000000      0.00000000
    T  
    F  
    F  
    F  
    T  
        0
         0.00000000      0.00000000      0.00000000
         0.00000000      0.00000000      0.00000000
  
  
    F  
    F  
    F  
    F  
    T  
        0
       -1     0     0     0
    F  
    F  
    F  
    F  
    F  
    F  
        2
    F  
    F  
    F  
    F  
    F  
    F  
        -2.00000000
        -2.00000000
        -1.00000000
    F  
       -1
         0.00000000
        0
        0
       -1
       -1
       -1
      200
        1
        3
        4
        0
       -30.00000000
       -30.00000000
      -200.00000000
        0
        -0.10000000
    F  
    F  
    F  
    F  
    F  
    F  
    F  
        1
        1
        1
     2800
        0
       -1
       -1
         0.80000001
         1.00000000
  
  
         0.00000000
         0.00000000      0.00000000      0.00000000
         0.00000000
         0.00000000
         0.00000000
  
  
    F  
  
 
 
        35 
         3 
  
   ion
   element
   atomtype
   
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    H    2
    H    2
    O    3
   
  
  
   type
   atomspertype
   element
   mass
   valence
   pseudopotential
   
      32Si     28.08500000      4.00000000  PAW_PBE Si 05Jan2001                  
       2H       1.00000000      1.00000000  PAW_PBE H 15Jun2001                   
       1O      16.00000000      6.00000000  PAW_PBE O 08Apr2002                   
   
  
 
 
  
   
           7.66310000       0.00000000       0.00000000 
           0.00000000      19.66310000       0.00000000 
           0.00000000       0.00000000      10.83726000 
   
      1632.96160543 
   
           0.13049549       0.00000000       0.00000000 
           0.00000000       0.05085668       0.00000000 
           0.00000000       0.00000000       0.09227425 
   
  
  
          0.92728754       0.52637589       0.10690300 
          0.84993344       0.23325044       0.42775095 
          0.13776045       0.44811204       0.19361350 
          0.09235258       0.28266713       0.33322158 
          0.81927432       0.33113341       0.02700435 
          0.95506732       0.42054833       0.51724270 
          0.08231250       0.33302705       0.13764340 
          0.19748341       0.40734169       0.38879181 
          0.83015144       0.54499216       0.52722290 
          0.77205255       0.24304065       0.88132999 
          0.06313267       0.50862459       0.65288086 
          0.01336636       0.20527430       0.75855278 
          0.90255149       0.30956240       0.59371915 
          0.86386150       0.44192838       0.95521600 
          0.14009623       0.32336575       0.73649625 
          0.09914047       0.43389162       0.82002448 
          0.42263919       0.46259122       0.12074399 
          0.36176559       0.28796294       0.42237527 
          0.68986121       0.48168329       0.20789001 
          0.63872799       0.31227270       0.34276398 
          0.32474499       0.31626732       0.01109161 
          0.43360725       0.43907317       0.52004240 
          0.56245405       0.34455057       0.14179412 
          0.69110553       0.43029503       0.40156594 
          0.31669118       0.55288103       0.54931953 
          0.27231272       0.23132761       0.86406146 
          0.60007226       0.51804988       0.66243960 
          0.53728269       0.20802975       0.75329707 
          0.39552833       0.32943557       0.62088705 
          0.36754886       0.42540300       0.92202527 
          0.66652385       0.32453952       0.72499518 
          0.62888509       0.43396332       0.81697374 
          0.65730676       0.70993485       0.62227001 
          0.68206911       0.72451309       0.55905294 
          0.46050937       0.58276243       0.67068933 
  
 
 
  
      12.50   12.51
      13.67   13.68
   
         24.76344702 
       8932.34040768 
     -12214.80841264 
       -264.26092932 
       3167.08814863 
      -2605.71786812 
         -0.00143945 
       -196.86856706 
       3755.32434067 
        597.85912741 
        597.86056687 
        597.85960723 
   
  
  
      15.59   15.60
      15.59   15.61
   
        -89.56186391 
        -89.56248585 
        -89.56207122 
   
  
  
      14.52   14.55
      14.52   14.55
   
       -162.56256299 
       -162.53727531 
       -162.55413376 
   
  
  
      15.69   15.73
      15.69   15.73
   
       -165.65971292 
       -165.63115893 
       -165.65019492 
   
  
  
      15.94   15.97
      16.27   16.30
   
       -165.80952391 
       -165.78089107 
       -165.79997963 
   
  
  
      15.55   15.58
      17.13   17.16
   
     -11020.88291027 
     -11020.88808945 
     -11020.88463666 
   
  
  
      13.74   13.79
      14.62   14.67
   
       -118.33529424 
       -118.32702440 
       -118.33253762 
   
  
  
      15.03   15.07
      15.93   15.97
   
       -137.98569582 
       -137.96383902 
       -137.97841022 
   
  
  
      15.05   15.11
      15.95   16.01
   
       -141.33002757 
       -141.30122618 
       -141.32042711 
   
  
  
      14.97   15.02
      15.90   15.95
   
       -146.66751678 
       -146.64364137 
       -146.65955831 
   
  
  
      14.52   14.56
      15.42   15.47
   
       -150.87485542 
       -150.86915424 
       -150.87295503 
   
  
  
      13.32   13.37
      14.26   14.31
   
       -162.65578397 
       -162.66023059 
       -162.65726618 
   
  
  
      13.75   13.80
      14.62   14.68
   
       -166.09488932 
       -166.11765702 
       -166.10247856 
   
  
  
      13.21   13.27
      14.08   14.14
   
       -161.19236590 
       -161.22152346 
       -161.20208509 
   
  
  
      14.76   14.84
      15.67   15.74
   
       -167.58473903 
       -167.61291272 
       -167.59413026 
   
  
  
      12.62   12.68
      13.52   13.58
   
       -165.26397109 
       -165.29039268 
       -165.27277829 
   
  
  
      19.27   19.31
      20.17   20.21
   
      -9580.97170633 
      -9580.94703960 
      -9580.96348409 
   
  
  
      13.60   13.65
      14.61   14.67
   
       -193.31460501 
       -193.34069375 
       -193.32330126