vasp 
  6.2.1  
  16May21 (build Apr 11 2022 11:03:26) complex                          parallel 
  Lin64 
  2024 09 01 
  23:49:00 
 
 
  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      0.73000000      0.32000000
  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 
    
   
   
           0.91308227       0.53588925       0.06450429 
           0.84433584       0.30938761       0.38584198 
           0.11682005       0.45863766       0.16074187 
           0.13126800       0.31217938       0.31255341 
           0.80324515       0.33248075       0.01301205 
           0.93411690       0.45768091       0.50686981 
           0.08347818       0.34172047       0.10490328 
           0.15689763       0.42862279       0.36764334 
           0.94515500       0.57440152       0.56123184 
           0.76256358       0.25509915       0.84707066 
           0.14937546       0.54637187       0.72046589 
           0.00067022       0.22693647       0.71347617 
           0.90530731       0.34392157       0.58595448 
           0.84833526       0.44224877       0.92872902 
           0.16278209       0.33816599       0.70773820 
           0.10818110       0.44117130       0.81432194 
           0.41867447       0.45464838       0.11351831 
           0.32816756       0.23840805       0.42983257 
           0.69625723       0.48269055       0.17721880 
           0.56127112       0.28879773       0.32686866 
           0.32397011       0.31450620       0.97993165 
           0.43047998       0.43626907       0.46537859 
           0.54050546       0.33930015       0.12990730 
           0.70737449       0.42367738       0.36644092 
           0.38915550       0.51923589       0.61189249 
           0.26855955       0.23667918       0.82099885 
           0.69539587       0.56025729       0.68612461 
           0.53895116       0.21716280       0.71248891 
           0.39405383       0.33153043       0.56659837 
           0.37355043       0.42729661       0.90921604 
           0.64925775       0.33727916       0.69496930 
           0.61308412       0.44685706       0.78125179 
           0.51344307       0.59166898       0.57052100 
           0.67502366       0.60710982       0.80644297 
           0.45872085       0.61490489       0.72513741 
           0.74955328       0.60035095       0.88357363 
   
  
  
           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 
          36 
  
 
 
  
          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
      108
       -1
       -1
       142.00000000
        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
         -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      0.73000000      0.32000000
      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     16.00000000      1.00000000
         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
        27.21602676
         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  
  
 
 
        36 
         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
    O    2
    O    2
    H    3
    H    3
   
  
  
   type
   atomspertype
   element
   mass
   valence
   pseudopotential
   
      32Si     28.08500000      4.00000000  PAW_PBE Si 05Jan2001                  
       2O      16.00000000      6.00000000  PAW_PBE O 08Apr2002                   
       2H       1.00000000      1.00000000  PAW_PBE H 15Jun2001                   
   
  
 
 
  
   
           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 
   
  
  
          0.91308227       0.53588925       0.06450429 
          0.84433584       0.30938761       0.38584198 
          0.11682005       0.45863766       0.16074187 
          0.13126800       0.31217938       0.31255341 
          0.80324515       0.33248075       0.01301205 
          0.93411690       0.45768091       0.50686981 
          0.08347818       0.34172047       0.10490328 
          0.15689763       0.42862279       0.36764334 
          0.94515500       0.57440152       0.56123184 
          0.76256358       0.25509915       0.84707066 
          0.14937546       0.54637187       0.72046589 
          0.00067022       0.22693647       0.71347617 
          0.90530731       0.34392157       0.58595448 
          0.84833526       0.44224877       0.92872902 
          0.16278209       0.33816599       0.70773820 
          0.10818110       0.44117130       0.81432194 
          0.41867447       0.45464838       0.11351831 
          0.32816756       0.23840805       0.42983257 
          0.69625723       0.48269055       0.17721880 
          0.56127112       0.28879773       0.32686866 
          0.32397011       0.31450620       0.97993165 
          0.43047998       0.43626907       0.46537859 
          0.54050546       0.33930015       0.12990730 
          0.70737449       0.42367738       0.36644092 
          0.38915550       0.51923589       0.61189249 
          0.26855955       0.23667918       0.82099885 
          0.69539587       0.56025729       0.68612461 
          0.53895116       0.21716280       0.71248891 
          0.39405383       0.33153043       0.56659837 
          0.37355043       0.42729661       0.90921604 
          0.64925775       0.33727916       0.69496930 
          0.61308412       0.44685706       0.78125179 
          0.51344307       0.59166898       0.57052100 
          0.67502366       0.60710982       0.80644297 
          0.45872085       0.61490489       0.72513741 
          0.74955328       0.60035095       0.88357363 
  
 
 
  
       9.81    9.84
      11.75   11.77
   
         27.86983208 
       9424.88748367 
     -13099.55092799 
       -235.92756214 
       3513.49417245 
      -2953.91778466 
         -0.00301322 
       -202.11938677 
       4187.58753671 
        662.32035014 
        662.32336336 
        662.32135455 
   
  
  
      12.81   12.83
      12.82   12.84
   
        -83.60276306 
        -83.59986711 
        -83.60179775 
   
  
  
      12.61   12.63
      12.61   12.63
   
       -172.64203537 
       -172.65836923 
       -172.64747999 
   
  
  
      12.64   12.66
      12.64   12.66
   
       -176.08412800 
       -176.09574668 
       -176.08800090 
   
  
  
      13.59   13.70
      13.82   13.93
   
       -176.23124013 
       -176.24264968 
       -176.23504331 
   
  
  
      10.65   10.76
      12.34   12.45
   
       -147.18498720 
       -147.16989452 
       -147.17995631 
   
  
  
      11.45   11.51
      12.65   12.72
   
       -145.31084663 
       -145.30585955 
       -145.30918427 
   
  
  
      13.55   13.64
      14.94   15.03
   
       -510.20622369 
       -510.19798888 
       -510.20347876 
   
  
  
      12.68   12.75
      14.36   14.43
   
       -139.99749841 
       -140.00033086 
       -139.99844256 
   
  
  
      12.24   12.29
      13.72   13.76
   
       -151.60984880 
       -151.61204624 
       -151.61058128 
   
  
  
      11.47   11.53
      12.54   12.61
   
       -156.92868172 
       -156.93006033 
       -156.92914126 
   
  
  
      12.07   12.10
      13.07   13.10
   
       -162.53400173 
       -162.55820014 
       -162.54206787