vasp 
  6.2.1  
  16May21 (build Apr 11 2022 11:03:26) complex                          parallel 
  Lin64 
  2024 08 31 
  14:38:56 
 
 
  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 
    
   
   
           0.93124221       0.52809367       0.10806161 
           0.84947505       0.23255415       0.42779332 
           0.13679391       0.44758803       0.19512628 
           0.09274098       0.28209061       0.33266339 
           0.81768714       0.33305377       0.02634592 
           0.95667312       0.42117776       0.51813939 
           0.08110388       0.33314633       0.13673726 
           0.19865400       0.40677116       0.39031668 
           0.83149963       0.54469370       0.52111872 
           0.77119882       0.24368614       0.88266351 
           0.06117409       0.51060641       0.65291705 
           0.01293847       0.20512553       0.76107977 
           0.90207770       0.30980619       0.59255996 
           0.86416903       0.44397754       0.95558006 
           0.13733804       0.32320630       0.73687669 
           0.09808934       0.43447715       0.81907175 
           0.42415348       0.45933057       0.12166470 
           0.36265296       0.29275109       0.42093138 
           0.69030160       0.48445165       0.20940326 
           0.64284784       0.31318914       0.34092986 
           0.32423513       0.31654945       0.00943889 
           0.43486884       0.43824422       0.52117976 
           0.56108617       0.34602439       0.14092721 
           0.69275708       0.42874111       0.40036523 
           0.32087316       0.55588063       0.55304111 
           0.27348086       0.23087103       0.86387440 
           0.60037358       0.51633617       0.65602514 
           0.53803424       0.20904043       0.75133377 
           0.39647534       0.32868837       0.62425187 
           0.36798330       0.42565790       0.91960998 
           0.67016939       0.32586213       0.72739726 
           0.63121902       0.43583376       0.81512152 
           0.65376455       0.70460356       0.62251198 
           0.67076055       0.71693106       0.56114469 
           0.45656784       0.57963106       0.67568890 
   
  
  
           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 
          0.50000000       0.00000000       0.00000000 
          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 
   
  
  
          0.93124221       0.52809367       0.10806161 
          0.84947505       0.23255415       0.42779332 
          0.13679391       0.44758803       0.19512628 
          0.09274098       0.28209061       0.33266339 
          0.81768714       0.33305377       0.02634592 
          0.95667312       0.42117776       0.51813939 
          0.08110388       0.33314633       0.13673726 
          0.19865400       0.40677116       0.39031668 
          0.83149963       0.54469370       0.52111872 
          0.77119882       0.24368614       0.88266351 
          0.06117409       0.51060641       0.65291705 
          0.01293847       0.20512553       0.76107977 
          0.90207770       0.30980619       0.59255996 
          0.86416903       0.44397754       0.95558006 
          0.13733804       0.32320630       0.73687669 
          0.09808934       0.43447715       0.81907175 
          0.42415348       0.45933057       0.12166470 
          0.36265296       0.29275109       0.42093138 
          0.69030160       0.48445165       0.20940326 
          0.64284784       0.31318914       0.34092986 
          0.32423513       0.31654945       0.00943889 
          0.43486884       0.43824422       0.52117976 
          0.56108617       0.34602439       0.14092721 
          0.69275708       0.42874111       0.40036523 
          0.32087316       0.55588063       0.55304111 
          0.27348086       0.23087103       0.86387440 
          0.60037358       0.51633617       0.65602514 
          0.53803424       0.20904043       0.75133377 
          0.39647534       0.32868837       0.62425187 
          0.36798330       0.42565790       0.91960998 
          0.67016939       0.32586213       0.72739726 
          0.63121902       0.43583376       0.81512152 
          0.65376455       0.70460356       0.62251198 
          0.67076055       0.71693106       0.56114469 
          0.45656784       0.57963106       0.67568890 
  
 
 
  
      12.53   12.56
      14.42   14.46
   
         24.76344702 
       8978.41695785 
     -12259.15852662 
       -264.14240493 
       3167.08814863 
      -2605.71786812 
         -0.00464873 
       -197.46843740 
       3755.32434067 
        599.10100837 
        599.10565710 
        599.10255795 
   
  
  
      15.57   15.58
      15.57   15.59
   
        -88.88097584 
        -88.87679410 
        -88.87958192 
   
  
  
      14.65   14.67
      14.66   14.67
   
       -162.26809682 
       -162.24498767 
       -162.26039377 
   
  
  
      15.30   15.33
      15.30   15.33
   
       -165.33008864 
       -165.30506301 
       -165.32174676 
   
  
  
      15.96   15.99
      16.10   16.14
   
       -165.48522460 
       -165.46018584 
       -165.47687834 
   
  
  
      14.77   14.83
      15.97   16.04
   
      -6723.59259786 
      -6723.60015660 
      -6723.59511744 
   
  
  
      14.09   14.12
      15.22   15.26
   
       -122.69009988 
       -122.68607607 
       -122.68875861 
   
  
  
      15.10   15.15
      15.99   16.04
   
       -141.19336167 
       -141.16241555 
       -141.18304629