vasp 
  6.2.1  
  16May21 (build Apr 11 2022 11:03:26) complex                          parallel 
  Lin64 
  2024 08 31 
  05:19:23 
 
 
  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 
    
   
   
           0.92954679       0.52743535       0.10662006 
           0.84922938       0.23297359       0.42774719 
           0.13600113       0.44774844       0.19591780 
           0.09182728       0.28331513       0.33399202 
           0.81777197       0.33170159       0.02697043 
           0.95622883       0.42095807       0.51783488 
           0.08171747       0.33309878       0.13713242 
           0.19889029       0.40614154       0.39030431 
           0.83198064       0.54501860       0.52449096 
           0.77187399       0.24315741       0.88170243 
           0.06313727       0.50978803       0.65283573 
           0.01393420       0.20529114       0.75948481 
           0.90206594       0.30977645       0.59329372 
           0.86342390       0.44254924       0.95540424 
           0.13880442       0.32319660       0.73692672 
           0.09779061       0.43407748       0.81952371 
           0.42242168       0.46046429       0.12183295 
           0.36336973       0.29003653       0.42144146 
           0.69074938       0.48235857       0.20837035 
           0.64176048       0.31283727       0.34133696 
           0.32584542       0.31641694       0.01063542 
           0.43380721       0.43858636       0.52118025 
           0.56226717       0.34690081       0.14216430 
           0.69191212       0.42900661       0.40145941 
           0.31788273       0.55540168       0.55017384 
           0.27335913       0.23096300       0.86430281 
           0.59845018       0.51667519       0.65699563 
           0.53785009       0.20826632       0.75261807 
           0.39599708       0.32916187       0.62263210 
           0.36771419       0.42535627       0.92031128 
           0.66823016       0.32520169       0.72639811 
           0.63003466       0.43520102       0.81524172 
           0.65482480       0.70704349       0.62544347 
           0.67813873       0.72198890       0.55688297 
           0.45662121       0.58057786       0.67228970 
   
  
  
           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 
          0.50000000       0.00000000       0.00000000 
          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 
   
  
  
          0.92954679       0.52743535       0.10662006 
          0.84922938       0.23297359       0.42774719 
          0.13600113       0.44774844       0.19591780 
          0.09182728       0.28331513       0.33399202 
          0.81777197       0.33170159       0.02697043 
          0.95622883       0.42095807       0.51783488 
          0.08171747       0.33309878       0.13713242 
          0.19889029       0.40614154       0.39030431 
          0.83198064       0.54501860       0.52449096 
          0.77187399       0.24315741       0.88170243 
          0.06313727       0.50978803       0.65283573 
          0.01393420       0.20529114       0.75948481 
          0.90206594       0.30977645       0.59329372 
          0.86342390       0.44254924       0.95540424 
          0.13880442       0.32319660       0.73692672 
          0.09779061       0.43407748       0.81952371 
          0.42242168       0.46046429       0.12183295 
          0.36336973       0.29003653       0.42144146 
          0.69074938       0.48235857       0.20837035 
          0.64176048       0.31283727       0.34133696 
          0.32584542       0.31641694       0.01063542 
          0.43380721       0.43858636       0.52118025 
          0.56226717       0.34690081       0.14216430 
          0.69191212       0.42900661       0.40145941 
          0.31788273       0.55540168       0.55017384 
          0.27335913       0.23096300       0.86430281 
          0.59845018       0.51667519       0.65699563 
          0.53785009       0.20826632       0.75261807 
          0.39599708       0.32916187       0.62263210 
          0.36771419       0.42535627       0.92031128 
          0.66823016       0.32520169       0.72639811 
          0.63003466       0.43520102       0.81524172 
          0.65482480       0.70704349       0.62544347 
          0.67813873       0.72198890       0.55688297 
          0.45662121       0.58057786       0.67228970 
  
 
 
  
      12.45   12.48
      14.04   14.07
   
         24.76344702 
       8964.52413456 
     -12247.05410089 
       -264.22014204 
       3167.08814863 
      -2605.71786812 
         -0.00129877 
       -196.65021525 
       3755.32434067 
        598.05644581 
        598.05774458 
        598.05687874 
   
  
  
      15.55   15.58
      15.56   15.58
   
        -89.60708494 
        -89.60479762 
        -89.60632250 
   
  
  
      14.89   14.92
      14.90   14.92
   
       -163.07488562 
       -163.04958954 
       -163.06645359 
   
  
  
      15.54   15.57
      15.54   15.58
   
       -166.09317690 
       -166.06575098 
       -166.08403492 
   
  
  
      16.11   16.15
      16.27   16.32
   
       -166.24147840 
       -166.21401668 
       -166.23232450 
   
  
  
      14.84   14.88
      16.01   16.04
   
      -2545.08232972 
      -2545.08643792 
      -2545.08369912 
   
  
  
      15.49   15.54
      16.53   16.58
   
       -380.25374637 
       -380.22525014 
       -380.24424763 
   
  
  
      15.11   15.17
      15.92   15.98
   
       -138.10102363 
       -138.07842169 
       -138.09348965