vasp 
  6.2.1  
  16May21 (build Apr 11 2022 11:03:26) complex                          parallel 
  Lin64 
  2024 09 02 
  15:09:31 
 
 
  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 
    
   
   
           0.92820288       0.52779314       0.10752375 
           0.85232083       0.23328035       0.42842014 
           0.13554485       0.44838127       0.19558428 
           0.09488779       0.28361328       0.33393124 
           0.81876398       0.33288328       0.02660476 
           0.95705038       0.42157120       0.51824395 
           0.08248964       0.33360674       0.13724595 
           0.19867342       0.40668990       0.38991079 
           0.83209168       0.54556455       0.52164348 
           0.77224068       0.24395648       0.88229585 
           0.06138494       0.51056539       0.65272923 
           0.01582285       0.20566790       0.76203408 
           0.90243053       0.31051739       0.59367340 
           0.86426454       0.44363625       0.95456128 
           0.13955839       0.32356818       0.73682434 
           0.09892003       0.43472374       0.81895285 
           0.42069810       0.46302094       0.12134487 
           0.36563056       0.28950542       0.42187173 
           0.68904338       0.48213723       0.20763891 
           0.64372905       0.31307016       0.34212339 
           0.32703928       0.31827208       0.01114970 
           0.43480675       0.43772949       0.52080583 
           0.56364703       0.34783011       0.14279703 
           0.69289210       0.42956091       0.40117832 
           0.31682514       0.55424017       0.54891377 
           0.27532411       0.23209705       0.86619406 
           0.59888840       0.51751537       0.65506757 
           0.53810878       0.20930506       0.75240445 
           0.39757176       0.32819063       0.62316777 
           0.36842762       0.42714534       0.92028225 
           0.66961184       0.32636459       0.72765049 
           0.63033704       0.43679203       0.81443783 
           0.65379610       0.69860168       0.62518742 
           0.66161671       0.71053946       0.56019530 
           0.45281907       0.58073540       0.66930212 
   
  
  
           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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          0.50000000       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 
   
  
  
          0.92820288       0.52779314       0.10752375 
          0.85232083       0.23328035       0.42842014 
          0.13554485       0.44838127       0.19558428 
          0.09488779       0.28361328       0.33393124 
          0.81876398       0.33288328       0.02660476 
          0.95705038       0.42157120       0.51824395 
          0.08248964       0.33360674       0.13724595 
          0.19867342       0.40668990       0.38991079 
          0.83209168       0.54556455       0.52164348 
          0.77224068       0.24395648       0.88229585 
          0.06138494       0.51056539       0.65272923 
          0.01582285       0.20566790       0.76203408 
          0.90243053       0.31051739       0.59367340 
          0.86426454       0.44363625       0.95456128 
          0.13955839       0.32356818       0.73682434 
          0.09892003       0.43472374       0.81895285 
          0.42069810       0.46302094       0.12134487 
          0.36563056       0.28950542       0.42187173 
          0.68904338       0.48213723       0.20763891 
          0.64372905       0.31307016       0.34212339 
          0.32703928       0.31827208       0.01114970 
          0.43480675       0.43772949       0.52080583 
          0.56364703       0.34783011       0.14279703 
          0.69289210       0.42956091       0.40117832 
          0.31682514       0.55424017       0.54891377 
          0.27532411       0.23209705       0.86619406 
          0.59888840       0.51751537       0.65506757 
          0.53810878       0.20930506       0.75240445 
          0.39757176       0.32819063       0.62316777 
          0.36842762       0.42714534       0.92028225 
          0.66961184       0.32636459       0.72765049 
          0.63033704       0.43679203       0.81443783 
          0.65379610       0.69860168       0.62518742 
          0.66161671       0.71053946       0.56019530 
          0.45281907       0.58073540       0.66930212 
  
 
 
  
      14.93   15.08
      15.62   15.77
   
         24.76344702 
       8995.23914914 
     -12276.45607905 
       -264.13726934 
       3167.08814863 
      -2605.71786812 
          0.00237237 
       -186.85071090 
       3755.32434067 
        609.25553043 
        609.25315806 
        609.25473964 
   
  
  
      18.48   18.48
      18.48   18.48
   
        -87.00614345 
        -86.97623347 
        -86.99617346 
   
  
  
      17.57   17.57
      17.57   17.57
   
       -162.47258801 
       -162.44746481 
       -162.46421361 
   
  
  
      18.44   18.44
      18.44   18.44
   
       -165.52738287 
       -165.50030970 
       -165.51835848 
   
  
  
      19.03   19.03
      19.17   19.17
   
       -165.66581282 
       -165.63862277 
       -165.65674947 
   
  
  
      15.46   15.45
      16.29   16.29
   
       -138.05942410 
       -138.04555865 
       -138.05480228 
   
  
  
      17.29   17.28
      18.13   18.12
   
      -1182.51574988 
      -1182.47988812 
      -1182.50379596 
   
  
  
      17.60   17.60
      18.44   18.44
   
       -126.82117401 
       -126.82720354 
       -126.82318386 
   
  
  
      18.29   18.28
      19.13   19.13
   
       -141.21927494 
       -141.21764833 
       -141.21873274 
   
  
  
      16.78   16.78
      17.65   17.65
   
       -148.25023205 
       -148.23719764 
       -148.24588725 
   
  
  
      17.80   17.80
      18.65   18.65
   
       -148.98643042 
       -148.98587558 
       -148.98624548 
   
  
  
      16.66   16.66
      17.50   17.50
   
       -155.84984569 
       -155.85407263 
       -155.85125467 
   
  
  
      15.26   15.26
      16.11   16.11
   
       -158.19085886 
       -158.20209485 
       -158.19460419 
   
  
  
      18.65   18.65
      19.50   19.50
   
       -171.57565588 
       -171.58666672 
       -171.57932616 
   
  
  
      15.28   15.28
      16.13   16.13
   
       -165.85052317 
       -165.87012075 
       -165.85705570 
   
  
  
      15.82   15.82
      16.69   16.68
   
       -168.30608703 
       -168.33323274 
       -168.31513560 
   
  
  
      15.98   15.98
      16.84   16.83
   
       -172.16990837 
       -172.19374125 
       -172.17785266 
   
  
  
      16.35   16.35
      17.21   17.20
   
       -173.80868051 
       -173.83352153 
       -173.81696085 
   
  
  
      16.32   16.32
      17.16   17.16
   
       -174.59626505 
       -174.62147082 
       -174.60466697 
   
  
  
      16.71   16.71
      17.62   17.61
   
       -174.28614764 
       -174.31156711 
       -174.29462080 
   
  
  
      19.17   19.17
      20.06   20.06
   
       -183.98779855 
       -184.01326412 
       -183.99628707 
   
  
  
      15.39   15.39
      16.26   16.26
   
       -166.58879681 
       -166.56242732 
       -166.58000698