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 
    
   
   
           0.92167578       0.52877377       0.10729147 
           0.86133546       0.23476350       0.43040264 
           0.13258886       0.45102029       0.19708042 
           0.10302378       0.28685647       0.33656276 
           0.82257009       0.33446486       0.02660672 
           0.95898646       0.42318012       0.51906404 
           0.08572902       0.33559229       0.13870872 
           0.19836442       0.40683848       0.38916605 
           0.83277051       0.54692305       0.51636280 
           0.77526835       0.24555688       0.88251927 
           0.05581429       0.51225268       0.65366406 
           0.02453919       0.20738589       0.76739530 
           0.90359655       0.31266489       0.59590755 
           0.86489143       0.44495981       0.95201040 
           0.14426336       0.32487454       0.73628692 
           0.10059896       0.43598845       0.81826038 
           0.41202687       0.47314814       0.11999790 
           0.37604308       0.28311356       0.42342477 
           0.68508135       0.47734287       0.20309739 
           0.65011795       0.31341197       0.34428215 
           0.33341493       0.32453799       0.01471210 
           0.43652581       0.43402221       0.51934043 
           0.57164220       0.35275961       0.14694083 
           0.69514749       0.43077619       0.40148344 
           0.30666290       0.54916281       0.54055226 
           0.28253372       0.23606155       0.87231331 
           0.59351638       0.51901102       0.64616835 
           0.53938626       0.21125171       0.75364894 
           0.40262367       0.32553511       0.62270187 
           0.36937796       0.43260964       0.92054633 
           0.67154364       0.32921178       0.73077197 
           0.62922248       0.44113501       0.81167654 
           0.64976439       0.67936691       0.63444637 
           0.62469946       0.68469952       0.56306680 
           0.44011313       0.57941854       0.65543095 
   
  
  
           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 
   
  
  
          0.92167578       0.52877377       0.10729147 
          0.86133546       0.23476350       0.43040264 
          0.13258886       0.45102029       0.19708042 
          0.10302378       0.28685647       0.33656276 
          0.82257009       0.33446486       0.02660672 
          0.95898646       0.42318012       0.51906404 
          0.08572902       0.33559229       0.13870872 
          0.19836442       0.40683848       0.38916605 
          0.83277051       0.54692305       0.51636280 
          0.77526835       0.24555688       0.88251927 
          0.05581429       0.51225268       0.65366406 
          0.02453919       0.20738589       0.76739530 
          0.90359655       0.31266489       0.59590755 
          0.86489143       0.44495981       0.95201040 
          0.14426336       0.32487454       0.73628692 
          0.10059896       0.43598845       0.81826038 
          0.41202687       0.47314814       0.11999790 
          0.37604308       0.28311356       0.42342477 
          0.68508135       0.47734287       0.20309739 
          0.65011795       0.31341197       0.34428215 
          0.33341493       0.32453799       0.01471210 
          0.43652581       0.43402221       0.51934043 
          0.57164220       0.35275961       0.14694083 
          0.69514749       0.43077619       0.40148344 
          0.30666290       0.54916281       0.54055226 
          0.28253372       0.23606155       0.87231331 
          0.59351638       0.51901102       0.64616835 
          0.53938626       0.21125171       0.75364894 
          0.40262367       0.32553511       0.62270187 
          0.36937796       0.43260964       0.92054633 
          0.67154364       0.32921178       0.73077197 
          0.62922248       0.44113501       0.81167654 
          0.64976439       0.67936691       0.63444637 
          0.62469946       0.68469952       0.56306680 
          0.44011313       0.57941854       0.65543095 
  
 
 
  
       6.27    6.43
       6.58    6.75
   
         24.76344702 
       9104.66520524 
     -12385.55414038 
       -268.48575492 
       3170.77911944 
      -2609.61052727 
         -0.01439078 
       -129.30480670 
       3755.32434067 
        662.56249232 
        662.57688310 
        662.56728925 
   
  
  
       7.73    7.73
       7.73    7.73
   
        -91.82110679 
        -91.81738311 
        -91.81986556 
   
  
  
       7.93    7.93
       7.93    7.93
   
       -176.08840499 
       -176.11414458 
       -176.09698485 
   
  
  
       7.70    7.70
       7.70    7.70
   
       -179.91607515 
       -179.94233762 
       -179.92482931 
   
  
  
       8.08    8.08
       8.15    8.15
   
       -180.06368118 
       -180.09001679 
       -180.07245972 
   
  
  
       7.67    7.67
       8.02    8.02
   
       -174.64040067 
       -174.66262579 
       -174.64780904