vasp 
  6.2.1  
  16May21 (build Apr 11 2022 11:03:26) complex                          parallel 
  Lin64 
  2024 09 01 
  22:41:03 
 
 
  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 
    
   
   
           0.91225639       0.52861780       0.10682569 
           0.85602034       0.23523958       0.42544235 
           0.12972661       0.45181179       0.19214972 
           0.10753850       0.28708578       0.34089593 
           0.83094663       0.33250734       0.02051046 
           0.96441668       0.42432855       0.52677177 
           0.08916668       0.33358191       0.13922780 
           0.19267413       0.40644420       0.38543112 
           0.82830400       0.54351096       0.51063723 
           0.77441621       0.24429672       0.87362862 
           0.05173103       0.51865141       0.64993710 
           0.02842575       0.20646234       0.76393204 
           0.90431904       0.31023943       0.59664242 
           0.87332507       0.44489935       0.94978545 
           0.14888653       0.32513496       0.73625985 
           0.10891875       0.44100058       0.80779453 
           0.40037466       0.48286032       0.11608843 
           0.39387673       0.27750109       0.42442235 
           0.67919545       0.47382762       0.19381207 
           0.65745895       0.32986953       0.35825043 
           0.33920682       0.32761010       0.01527707 
           0.42505759       0.43807743       0.51220111 
           0.58197028       0.34822237       0.14570480 
           0.69033685       0.42142636       0.39687365 
           0.33034796       0.54589870       0.57725562 
           0.28098639       0.23634224       0.87542756 
           0.62721041       0.54761853       0.66864768 
           0.53573544       0.21487958       0.75330593 
           0.40310366       0.33195682       0.61689619 
           0.37632499       0.43566442       0.91840223 
           0.66967241       0.33687433       0.73139560 
           0.63860615       0.44453739       0.81730869 
           0.66788896       0.61841599       0.75309969 
           0.51945991       0.64619727       0.53505170 
           0.43757433       0.61707932       0.55659935 
   
  
  
           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 
   
  
  
          0.91225639       0.52861780       0.10682569 
          0.85602034       0.23523958       0.42544235 
          0.12972661       0.45181179       0.19214972 
          0.10753850       0.28708578       0.34089593 
          0.83094663       0.33250734       0.02051046 
          0.96441668       0.42432855       0.52677177 
          0.08916668       0.33358191       0.13922780 
          0.19267413       0.40644420       0.38543112 
          0.82830400       0.54351096       0.51063723 
          0.77441621       0.24429672       0.87362862 
          0.05173103       0.51865141       0.64993710 
          0.02842575       0.20646234       0.76393204 
          0.90431904       0.31023943       0.59664242 
          0.87332507       0.44489935       0.94978545 
          0.14888653       0.32513496       0.73625985 
          0.10891875       0.44100058       0.80779453 
          0.40037466       0.48286032       0.11608843 
          0.39387673       0.27750109       0.42442235 
          0.67919545       0.47382762       0.19381207 
          0.65745895       0.32986953       0.35825043 
          0.33920682       0.32761010       0.01527707 
          0.42505759       0.43807743       0.51220111 
          0.58197028       0.34822237       0.14570480 
          0.69033685       0.42142636       0.39687365 
          0.33034796       0.54589870       0.57725562 
          0.28098639       0.23634224       0.87542756 
          0.62721041       0.54761853       0.66864768 
          0.53573544       0.21487958       0.75330593 
          0.40310366       0.33195682       0.61689619 
          0.37632499       0.43566442       0.91840223 
          0.66967241       0.33687433       0.73139560 
          0.63860615       0.44453739       0.81730869 
          0.66788896       0.61841599       0.75309969 
          0.51945991       0.64619727       0.53505170 
          0.43757433       0.61707932       0.55659935 
  
 
 
  
      12.07   12.09
      13.78   13.80
   
         24.76344702 
       8843.77413698 
     -12116.26600053 
       -264.04441793 
       3167.08814863 
      -2605.71786812 
          0.00705665 
       -203.28454684 
       3755.32434067 
        601.64429655 
        601.63723989 
        601.64194433 
   
  
  
      15.58   15.59
      15.58   15.59
   
        -88.90300163 
        -88.88772834 
        -88.89791053 
   
  
  
      14.74   14.76
      14.74   14.76
   
       -162.31000257 
       -162.30028334 
       -162.30676283 
   
  
  
      15.34   15.38
      15.34   15.38
   
       -165.02439092 
       -165.01339398 
       -165.02072527 
   
  
  
      16.58   16.61
      16.74   16.77
   
       -165.14293866 
       -165.13190216 
       -165.13925982 
   
  
  
      11.65   11.70
      12.61   12.66
   
       -140.03099302 
       -140.01504806 
       -140.02567803 
   
  
  
      13.68   13.73
      14.61   14.66
   
       -138.48643969 
       -138.47173283 
       -138.48153741 
   
  
  
      14.62   14.66
      15.51   15.55
   
       -140.05655648 
       -140.05029417 
       -140.05446904 
   
  
  
      13.50   13.52
      14.42   14.44
   
       -144.67752537 
       -144.68350295 
       -144.67951790 
   
  
  
      13.60   13.64
      14.51   14.56
   
       -149.04000964 
       -149.05301315 
       -149.04434414 
   
  
  
      13.07   13.11
      13.98   14.03
   
       -158.88262279 
       -158.87240606 
       -158.87921721 
   
  
  
      13.46   13.51
      14.38   14.43
   
       -164.69199917 
       -164.68607236 
       -164.69002356 
   
  
  
      13.64   13.67
      14.59   14.62
   
       -167.38184661 
       -167.39333785 
       -167.38567702 
   
  
  
      13.83   13.87
      14.86   14.90
   
       -168.37486433 
       -168.39166823 
       -168.38046563 
   
  
  
      13.86   13.90
      14.84   14.88
   
       -168.85255856 
       -168.87133782 
       -168.85881831 
   
  
  
      13.63   13.68
      14.59   14.64
   
       -169.14769096 
       -169.16729884 
       -169.15422692 
   
  
  
      13.74   13.78
      14.67   14.71
   
       -169.28637663 
       -169.30654549 
       -169.29309959 
   
  
  
      13.58   13.62
      14.66   14.70
   
       -169.37849250 
       -169.39884192 
       -169.38527564 
   
  
  
      14.05   14.09
      14.95   15.00
   
       -169.42492503 
       -169.44525338 
       -169.43170115 
   
  
  
      13.43   13.47
      14.33   14.38
   
       -169.45825147 
       -169.47860109 
       -169.46503468