vasp 
  6.2.1  
  16May21 (build Apr 11 2022 11:03:26) complex                          parallel 
  Lin64 
  2024 09 02 
  18:19:33 
 
 
  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 
    
   
   
           0.92818606       0.52838389       0.10853455 
           0.85396663       0.23333097       0.42862773 
           0.13496187       0.44857594       0.19605376 
           0.09680968       0.28356182       0.33377479 
           0.81859625       0.33407741       0.02618538 
           0.95825117       0.42209446       0.51895145 
           0.08261473       0.33384058       0.13719161 
           0.19888427       0.40712986       0.39012982 
           0.83272371       0.54595831       0.51808876 
           0.77210296       0.24456917       0.88295437 
           0.05993374       0.51158060       0.65252405 
           0.01677662       0.20582177       0.76419693 
           0.90224895       0.31100749       0.59354632 
           0.86458588       0.44483866       0.95419076 
           0.13918689       0.32367098       0.73687168 
           0.09881954       0.43528746       0.81829085 
           0.41948580       0.46377128       0.12127576 
           0.36728634       0.29055008       0.42169151 
           0.68808756       0.48262755       0.20728163 
           0.64572331       0.31296266       0.34162947 
           0.32803953       0.31935799       0.01129919 
           0.43543581       0.43706578       0.52078047 
           0.56409752       0.34839932       0.14319144 
           0.69396427       0.42985435       0.40081957 
           0.31484705       0.55424326       0.54788465 
           0.27702762       0.23250351       0.86737448 
           0.59915501       0.51817730       0.65218791 
           0.53846018       0.21015366       0.75152872 
           0.39883257       0.32716264       0.62441879 
           0.36905253       0.42832092       0.91953493 
           0.67146642       0.32737979       0.72903782 
           0.63115407       0.43819261       0.81333955 
           0.65285747       0.69171552       0.62733762 
           0.65138411       0.70305284       0.56030115 
           0.45045411       0.57945174       0.67086467 
   
  
  
           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
      104
       -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
  
  
        1
        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
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    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 
   
  
  
          0.92818606       0.52838389       0.10853455 
          0.85396663       0.23333097       0.42862773 
          0.13496187       0.44857594       0.19605376 
          0.09680968       0.28356182       0.33377479 
          0.81859625       0.33407741       0.02618538 
          0.95825117       0.42209446       0.51895145 
          0.08261473       0.33384058       0.13719161 
          0.19888427       0.40712986       0.39012982 
          0.83272371       0.54595831       0.51808876 
          0.77210296       0.24456917       0.88295437 
          0.05993374       0.51158060       0.65252405 
          0.01677662       0.20582177       0.76419693 
          0.90224895       0.31100749       0.59354632 
          0.86458588       0.44483866       0.95419076 
          0.13918689       0.32367098       0.73687168 
          0.09881954       0.43528746       0.81829085 
          0.41948580       0.46377128       0.12127576 
          0.36728634       0.29055008       0.42169151 
          0.68808756       0.48262755       0.20728163 
          0.64572331       0.31296266       0.34162947 
          0.32803953       0.31935799       0.01129919 
          0.43543581       0.43706578       0.52078047 
          0.56409752       0.34839932       0.14319144 
          0.69396427       0.42985435       0.40081957 
          0.31484705       0.55424326       0.54788465 
          0.27702762       0.23250351       0.86737448 
          0.59915501       0.51817730       0.65218791 
          0.53846018       0.21015366       0.75152872 
          0.39883257       0.32716264       0.62441879 
          0.36905253       0.42832092       0.91953493 
          0.67146642       0.32737979       0.72903782 
          0.63115407       0.43819261       0.81333955 
          0.65285747       0.69171552       0.62733762 
          0.65138411       0.70305284       0.56030115 
          0.45045411       0.57945174       0.67086467 
  
 
 
  
      14.49   14.57
      15.22   15.30
   
         24.76344702 
       9016.25886874 
     -12298.49203312 
       -264.18170554 
       3167.08814863 
      -2605.71786812 
          0.00659743 
       -186.24873766 
       3755.32434067 
        608.80105806 
        608.79446063 
        608.79885892 
   
  
  
      18.37   18.37
      18.37   18.37
   
        -87.12642257 
        -87.10161915 
        -87.11815477 
   
  
  
      17.65   17.65
      17.65   17.65
   
       -162.57262937 
       -162.54858387 
       -162.56461420 
   
  
  
      18.39   18.39
      18.39   18.39
   
       -165.60262108 
       -165.57684949 
       -165.59403055 
   
  
  
      19.31   19.31
      19.46   19.45
   
       -165.74349382 
       -165.71757447 
       -165.73485404 
   
  
  
      18.28   18.28
      19.14   19.14
   
      -7472.04301705 
      -7472.02037516 
      -7472.03546975 
   
  
  
      19.15   19.14
      19.97   19.97
   
      -4705.98837971 
      -4705.99562106 
      -4705.99079349 
   
  
  
      18.06   18.06
      18.89   18.88
   
       -134.87737191 
       -134.88176174 
       -134.87883519