vasp 
  6.2.1  
  16May21 (build Apr 11 2022 11:03:26) complex                          parallel 
  Lin64 
  2024 09 01 
  19:24:31 
 
 
  No title
       0
  Normal
  Normal (blocked Davidson)
   F  
       1
       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 
    
   
   
           0.89960935       0.52180318       0.10541701 
           0.87871589       0.24252219       0.43400985 
           0.14469773       0.46321472       0.18376046 
           0.12842830       0.29182067       0.34511259 
           0.84437534       0.33086892       0.02743029 
           0.95533374       0.42296091       0.51335885 
           0.09829127       0.33770169       0.14875893 
           0.18657041       0.41305415       0.37307557 
           0.82204685       0.54823674       0.53459139 
           0.78510605       0.24750993       0.87502792 
           0.07693574       0.51208056       0.64106414 
           0.04218828       0.21211075       0.76428559 
           0.90701939       0.31587363       0.60546493 
           0.87531138       0.44174594       0.94655902 
           0.16388315       0.32962861       0.73182946 
           0.11846224       0.44004886       0.81629613 
           0.40246257       0.51470762       0.11496718 
           0.38917442       0.25045640       0.43643958 
           0.66195698       0.46283439       0.19379335 
           0.63728353       0.30140190       0.35331150 
           0.34862739       0.33532803       0.02751585 
           0.42824906       0.43394968       0.49863462 
           0.60231990       0.34361101       0.15406044 
           0.69885752       0.45227894       0.40640767 
           0.36177062       0.54214264       0.58196223 
           0.28358978       0.24716058       0.88212999 
           0.61766301       0.54245415       0.69985889 
           0.53597622       0.21616552       0.76521289 
           0.40834050       0.32750181       0.60227618 
           0.37254943       0.44505272       0.93861909 
           0.66119347       0.33389841       0.72850505 
           0.62827972       0.44324058       0.82149518 
           0.64260486       0.60614145       0.77567675 
           0.48202923       0.62972504       0.47785381 
           0.36555696       0.60943980       0.48712979 
   
  
  
           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
       86
       -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
   
   
         1
     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
           0.00000003
           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      0.32000000      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 
   
  
  
          0.89960935       0.52180318       0.10541701 
          0.87871589       0.24252219       0.43400985 
          0.14469773       0.46321472       0.18376046 
          0.12842830       0.29182067       0.34511259 
          0.84437534       0.33086892       0.02743029 
          0.95533374       0.42296091       0.51335885 
          0.09829127       0.33770169       0.14875893 
          0.18657041       0.41305415       0.37307557 
          0.82204685       0.54823674       0.53459139 
          0.78510605       0.24750993       0.87502792 
          0.07693574       0.51208056       0.64106414 
          0.04218828       0.21211075       0.76428559 
          0.90701939       0.31587363       0.60546493 
          0.87531138       0.44174594       0.94655902 
          0.16388315       0.32962861       0.73182946 
          0.11846224       0.44004886       0.81629613 
          0.40246257       0.51470762       0.11496718 
          0.38917442       0.25045640       0.43643958 
          0.66195698       0.46283439       0.19379335 
          0.63728353       0.30140190       0.35331150 
          0.34862739       0.33532803       0.02751585 
          0.42824906       0.43394968       0.49863462 
          0.60231990       0.34361101       0.15406044 
          0.69885752       0.45227894       0.40640767 
          0.36177062       0.54214264       0.58196223 
          0.28358978       0.24716058       0.88212999 
          0.61766301       0.54245415       0.69985889 
          0.53597622       0.21616552       0.76521289 
          0.40834050       0.32750181       0.60227618 
          0.37254943       0.44505272       0.93861909 
          0.66119347       0.33389841       0.72850505 
          0.62827972       0.44324058       0.82149518 
          0.64260486       0.60614145       0.77567675 
          0.48202923       0.62972504       0.47785381 
          0.36555696       0.60943980       0.48712979 
  
 
 
  
       6.13    6.27
       6.44    6.57
   
         24.76344702 
       8732.75990083 
     -12018.77185123 
       -269.23658732 
       3170.77911944 
      -2609.61052727 
         -0.01291079 
       -133.48546702 
       3755.32434067 
        652.50946433 
        652.52237512 
        652.51376793 
   
  
  
       7.76    7.76
       7.76    7.76
   
        -95.56439925 
        -95.58712160 
        -95.57197336 
   
  
  
       7.71    7.71
       7.72    7.72
   
       -176.57459221 
       -176.57217962 
       -176.57378801 
   
  
  
       7.93    7.93
       7.94    7.93
   
       -180.19499746 
       -180.18646703 
       -180.19215399 
   
  
  
       8.39    8.39
       8.48    8.48
   
       -180.31261174 
       -180.30402837 
       -180.30975062 
   
  
  
       7.06    7.06
       7.41    7.41
   
       -175.33132170 
       -175.33522662 
       -175.33262334