vasp 
  6.2.1  
  16May21 (build Apr 11 2022 11:03:26) complex                          parallel 
  Lin64 
  2024 08 30 
  19:00:21 
 
 
  No title
       0
  Normal
  Normal (blocked Davidson)
   F  
       1
       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 
    
   
   
           0.94605205       0.53533854       0.09825850 
           0.86465513       0.23621994       0.41097857 
           0.14596092       0.45276565       0.18229062 
           0.11463906       0.28743980       0.31837048 
           0.82030845       0.33837305       0.02135196 
           0.97758309       0.42046955       0.51745040 
           0.09166816       0.33901511       0.12150744 
           0.20028584       0.40675064       0.37442309 
           0.83880087       0.55387208       0.52585787 
           0.77508578       0.25134386       0.87213664 
           0.06637498       0.50898612       0.65404863 
           0.01082612       0.20995847       0.74857025 
           0.90844905       0.30950507       0.58442314 
           0.87082193       0.44888211       0.95585407 
           0.14628499       0.32572699       0.73169992 
           0.11001435       0.43517562       0.82337548 
           0.43926113       0.46012978       0.11571261 
           0.38463164       0.29614690       0.41101697 
           0.70685922       0.49208303       0.20076080 
           0.66440175       0.31973028       0.33267200 
           0.33327025       0.31875886       0.99440050 
           0.44591706       0.42979335       0.49792043 
           0.56254201       0.34677343       0.13454855 
           0.72128736       0.43903552       0.39618976 
           0.35852562       0.52963977       0.60598941 
           0.27730204       0.23115635       0.85261167 
           0.62928325       0.55115943       0.69716445 
           0.54467334       0.21700484       0.73886199 
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           0.39026618       0.42902852       0.91048421 
           0.68668377       0.33771854       0.72207266 
           0.64990541       0.45116645       0.80445663 
           0.56674407       0.62228936       0.76886217 
           0.40473448       0.63916351       0.66221357 
           0.39316736       0.61342225       0.58500192 
   
  
  
           1 
           2 
           3 
           4 
           5 
           6 
           7 
           8 
           9 
          10 
          11 
          12 
          13 
          14 
          15 
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          19 
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          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 
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         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
       86
       -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
   
   
         1
     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
           0.00000003
           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
         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 
   
  
  
          0.94605205       0.53533854       0.09825850 
          0.86465513       0.23621994       0.41097857 
          0.14596092       0.45276565       0.18229062 
          0.11463906       0.28743980       0.31837048 
          0.82030845       0.33837305       0.02135196 
          0.97758309       0.42046955       0.51745040 
          0.09166816       0.33901511       0.12150744 
          0.20028584       0.40675064       0.37442309 
          0.83880087       0.55387208       0.52585787 
          0.77508578       0.25134386       0.87213664 
          0.06637498       0.50898612       0.65404863 
          0.01082612       0.20995847       0.74857025 
          0.90844905       0.30950507       0.58442314 
          0.87082193       0.44888211       0.95585407 
          0.14628499       0.32572699       0.73169992 
          0.11001435       0.43517562       0.82337548 
          0.43926113       0.46012978       0.11571261 
          0.38463164       0.29614690       0.41101697 
          0.70685922       0.49208303       0.20076080 
          0.66440175       0.31973028       0.33267200 
          0.33327025       0.31875886       0.99440050 
          0.44591706       0.42979335       0.49792043 
          0.56254201       0.34677343       0.13454855 
          0.72128736       0.43903552       0.39618976 
          0.35852562       0.52963977       0.60598941 
          0.27730204       0.23115635       0.85261167 
          0.62928325       0.55115943       0.69716445 
          0.54467334       0.21700484       0.73886199 
          0.40819341       0.32464934       0.62035437 
          0.39026618       0.42902852       0.91048421 
          0.68668377       0.33771854       0.72207266 
          0.64990541       0.45116645       0.80445663 
          0.56674407       0.62228936       0.76886217 
          0.40473448       0.63916351       0.66221357 
          0.39316736       0.61342225       0.58500192