vasp 
  6.2.1  
  16May21 (build Apr 11 2022 11:03:26) complex                          parallel 
  Lin64 
  2024 08 31 
  19:58:17 
 
 
  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 
    
   
   
           0.92942149       0.53000060       0.10926899 
           0.85383319       0.23387795       0.42719027 
           0.13510079       0.44916572       0.19605249 
           0.09767855       0.28348520       0.33212012 
           0.81797876       0.33564116       0.02570784 
           0.95713824       0.42243621       0.51641123 
           0.08219207       0.33468638       0.13607750 
           0.20088819       0.40755590       0.39001558 
           0.82794677       0.54702140       0.51879844 
           0.77227202       0.24574424       0.88362027 
           0.05633590       0.51203172       0.65054762 
           0.01549637       0.20635363       0.76447235 
           0.90375436       0.31147609       0.59211812 
           0.86670214       0.44643547       0.95537143 
           0.13796896       0.32474484       0.73682060 
           0.09807351       0.43673951       0.81717103 
           0.42087384       0.46253992       0.12091649 
           0.36726932       0.29331510       0.42128267 
           0.68737723       0.48524775       0.20873042 
           0.64612533       0.31368875       0.33972169 
           0.32726478       0.32063756       0.00925220 
           0.43624926       0.43750108       0.52314031 
           0.56319920       0.34918509       0.14179335 
           0.69209313       0.43030288       0.40044272 
           0.31693700       0.55394729       0.55096129 
           0.27637055       0.23381394       0.86594801 
           0.59839145       0.51834228       0.65575905 
           0.53898104       0.21183090       0.75097465 
           0.39948524       0.32768210       0.62587100 
           0.36905916       0.42946600       0.91756812 
           0.67451719       0.32817038       0.72875517 
           0.63386876       0.43841441       0.81512577 
           0.65998827       0.67832480       0.62844008 
           0.64488985       0.68955509       0.56254934 
           0.44973827       0.57931075       0.67289599 
   
  
  
           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
      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
         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 
   
  
  
          0.92942149       0.53000060       0.10926899 
          0.85383319       0.23387795       0.42719027 
          0.13510079       0.44916572       0.19605249 
          0.09767855       0.28348520       0.33212012 
          0.81797876       0.33564116       0.02570784 
          0.95713824       0.42243621       0.51641123 
          0.08219207       0.33468638       0.13607750 
          0.20088819       0.40755590       0.39001558 
          0.82794677       0.54702140       0.51879844 
          0.77227202       0.24574424       0.88362027 
          0.05633590       0.51203172       0.65054762 
          0.01549637       0.20635363       0.76447235 
          0.90375436       0.31147609       0.59211812 
          0.86670214       0.44643547       0.95537143 
          0.13796896       0.32474484       0.73682060 
          0.09807351       0.43673951       0.81717103 
          0.42087384       0.46253992       0.12091649 
          0.36726932       0.29331510       0.42128267 
          0.68737723       0.48524775       0.20873042 
          0.64612533       0.31368875       0.33972169 
          0.32726478       0.32063756       0.00925220 
          0.43624926       0.43750108       0.52314031 
          0.56319920       0.34918509       0.14179335 
          0.69209313       0.43030288       0.40044272 
          0.31693700       0.55394729       0.55096129 
          0.27637055       0.23381394       0.86594801 
          0.59839145       0.51834228       0.65575905 
          0.53898104       0.21183090       0.75097465 
          0.39948524       0.32768210       0.62587100 
          0.36905916       0.42946600       0.91756812 
          0.67451719       0.32817038       0.72875517 
          0.63386876       0.43841441       0.81512577 
          0.65998827       0.67832480       0.62844008 
          0.64488985       0.68955509       0.56254934 
          0.44973827       0.57931075       0.67289599 
  
 
 
  
      14.77   14.89
      15.47   15.59
   
         24.76344702 
       9080.61190135 
     -12360.86248280 
       -263.98081709 
       3167.08814863 
      -2605.71786812 
          0.01175720 
       -186.64966705 
       3755.32434067 
        610.58875980 
        610.57700261 
        610.58484074 
   
  
  
      18.36   18.35
      18.36   18.36
   
        -86.79773442 
        -86.77023200 
        -86.78856695 
   
  
  
      17.67   17.67
      17.67   17.67
   
       -162.51100611 
       -162.48482568 
       -162.50227930 
   
  
  
      18.50   18.49
      18.50   18.50
   
       -165.57157216 
       -165.54274085 
       -165.56196172 
   
  
  
      18.79   18.79
      18.92   18.92
   
       -165.70573689 
       -165.67677993 
       -165.69608457 
   
  
  
      17.20   17.20
      18.05   18.05
   
      -2450.82033513 
      -2450.79041694 
      -2450.81036240 
   
  
  
      16.95   16.95
      17.75   17.75
   
       -123.17177542 
       -123.15314975 
       -123.16556686 
   
  
  
      16.52   16.52
      17.31   17.30
   
       -136.93720281 
       -136.90655420 
       -136.92698661 
   
  
  
      17.61   17.61
      18.44   18.44
   
       -142.00761589 
       -141.98409198 
       -141.99977459 
   
  
  
      17.34   17.34
      18.21   18.21
   
       -146.01005507 
       -145.99038646 
       -146.00349887 
   
  
  
      16.56   16.55
      17.41   17.41
   
       -154.02702551 
       -154.03078992 
       -154.02828031