vasp 
  6.2.1  
  16May21 (build Apr 11 2022 11:03:26) complex                          parallel 
  Lin64 
  2024 09 02 
  17:03:04 
 
 
  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
        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      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      0.00000000      0.00000000      0.00000000      0.00000000      0.00000000      0.00000000      0.00000000      0.00000000      0.10700000
  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 
    
   
   
           0.20842089       0.21225198       0.35128826 
           0.42741062       0.92709092       0.63754642 
           0.86418742       0.59947109       0.67323344 
           0.72427305       0.77125842       0.87946864 
           0.02117387       0.17548251       0.30087147 
           0.17349858       0.19458008       0.47427883 
           0.69468422       0.95549021       0.25338343 
           0.63652025       0.68600234       0.53191399 
           0.16017261       0.71837240       0.90219247 
           0.28586616       0.17734495       0.52147057 
           0.58327493       0.29332426       0.67273704 
           0.54865422       0.62524481       0.71353154 
           0.46214797       0.95593083       0.92977267 
           0.45470072       0.50106991       0.70221547 
           0.73807217       0.72983294       0.61383379 
           0.43336375       0.36998272       0.11383597 
           0.59516811       0.32437533       0.83368307 
           0.77263996       0.23596856       0.87954552 
           0.75265374       0.83047808       0.38566841 
           0.77637503       0.33820295       0.78560718 
           0.63616133       0.01150804       0.34691856 
           0.68736798       0.45839103       0.90526805 
           0.26663471       0.15123834       0.37864946 
           0.41173982       0.00211064       0.80777111 
           0.11912403       0.48435889       0.09075687 
           0.74092276       0.00042314       0.04846567 
           0.46811059       0.59631189       0.39140574 
           0.28529958       0.97591078       0.05308982 
           0.21342329       0.13651056       0.39075432 
           0.01607957       0.91601583       0.47100997 
           0.31529635       0.77180908       0.96637899 
           0.11961397       0.29508478       0.26127129 
           0.91196141       0.25692066       0.05702410 
           0.65561559       0.72933185       0.33620890 
           0.73465116       0.73839796       0.61555495 
   
  
  
           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
       88
       -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  
          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      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      0.00000000      0.00000000      0.00000000      0.00000000      0.00000000      0.00000000      0.00000000      0.00000000      0.10700000
         -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      0.73000000      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
  
  
        4
        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
        27.99362752
         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
    O    2
    H    3
    H    3
   
  
  
   type
   atomspertype
   element
   mass
   valence
   pseudopotential
   
      32Si     28.08500000      4.00000000  PAW_PBE Si 05Jan2001                  
       1O      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 
   
  
  
          0.20842089       0.21225198       0.35128826 
          0.42741062       0.92709092       0.63754642 
          0.86418742       0.59947109       0.67323344 
          0.72427305       0.77125842       0.87946864 
          0.02117387       0.17548251       0.30087147 
          0.17349858       0.19458008       0.47427883 
          0.69468422       0.95549021       0.25338343 
          0.63652025       0.68600234       0.53191399 
          0.16017261       0.71837240       0.90219247 
          0.28586616       0.17734495       0.52147057 
          0.58327493       0.29332426       0.67273704 
          0.54865422       0.62524481       0.71353154 
          0.46214797       0.95593083       0.92977267 
          0.45470072       0.50106991       0.70221547 
          0.73807217       0.72983294       0.61383379 
          0.43336375       0.36998272       0.11383597 
          0.59516811       0.32437533       0.83368307 
          0.77263996       0.23596856       0.87954552 
          0.75265374       0.83047808       0.38566841 
          0.77637503       0.33820295       0.78560718 
          0.63616133       0.01150804       0.34691856 
          0.68736798       0.45839103       0.90526805 
          0.26663471       0.15123834       0.37864946 
          0.41173982       0.00211064       0.80777111 
          0.11912403       0.48435889       0.09075687 
          0.74092276       0.00042314       0.04846567 
          0.46811059       0.59631189       0.39140574 
          0.28529958       0.97591078       0.05308982 
          0.21342329       0.13651056       0.39075432 
          0.01607957       0.91601583       0.47100997 
          0.31529635       0.77180908       0.96637899 
          0.11961397       0.29508478       0.26127129 
          0.91196141       0.25692066       0.05702410 
          0.65561559       0.72933185       0.33620890 
          0.73465116       0.73839796       0.61555495 
  
 
 
  
       5.72    5.83
       6.17    6.28
   
         24.76344702 
       -220.33416352 
      -2230.13751649 
       -286.36774471 
       3170.77583059 
      -2609.60722799 
         -0.00132729 
       -273.12387094 
       3755.32434067 
       1331.29176735 
       1331.29309464 
       1331.29220978 
   
  
  
       8.11    8.16
       8.11    8.16
   
        596.62951959 
        596.65083352 
        596.63662423 
   
  
  
       9.35    9.41
       9.35    9.42
   
        426.24126434 
        426.25894897 
        426.24715922 
   
  
  
       7.97    8.03
       7.97    8.03
   
        413.47496678 
        413.50476149 
        413.48489835 
   
  
  
       8.55    8.62
       8.70    8.77
   
        412.71768476 
        412.73276925 
        412.72271292 
   
  
  
       8.06    8.12
       8.66    8.73
   
        447.70050818 
        447.71702354 
        447.70601330 
   
  
  
       9.47    9.53
      10.05   10.11
   
        150.57914167 
        150.57404790 
        150.57744374 
   
  
  
       8.60    8.67
       9.15    9.22
   
        560.85656697 
        560.87422669 
        560.86245354 
   
  
  
       7.80    7.85
       8.37    8.43
   
        517.32700990 
        517.31070472 
        517.32157484 
   
  
  
       7.57    7.63
       8.14    8.19
   
        519.04909705 
        519.02523442 
        519.04114284 
   
  
  
       8.04    8.12
       8.64    8.73
   
        537.85823105 
        537.86628190 
        537.86091467 
   
  
  
       7.46    7.51
       8.06    8.12
   
        545.52533248 
        545.55265293 
        545.53443930 
   
  
  
       7.87    7.92
       8.44    8.50
   
        541.26954198 
        541.29783640 
        541.27897345 
   
  
  
       7.52    7.58
       8.08    8.14
   
        545.27769745 
        545.26031160 
        545.27190217 
   
  
  
       7.49    7.54
       8.05    8.10
   
        544.72191180 
        544.71533832 
        544.71972064 
   
  
  
       7.79    7.85
       8.35    8.41
   
        547.70717145 
        547.71065477 
        547.70833255 
   
  
  
       7.10    7.16
       7.66    7.72
   
        547.61954445 
        547.60432864 
        547.61447252