vasp 
  6.2.1  
  16May21 (build Apr 11 2022 11:03:26) complex                          parallel 
  Lin64 
  2024 08 31 
  20:22:08 
 
 
  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 
    
   
   
           0.93032549       0.52892219       0.10889721 
           0.85153893       0.23310414       0.42710473 
           0.13657351       0.44849773       0.19559188 
           0.09530048       0.28236361       0.33221540 
           0.81720587       0.33429647       0.02585827 
           0.95684942       0.42165900       0.51720978 
           0.08161169       0.33386241       0.13644279 
           0.20018896       0.40760540       0.39017777 
           0.82997397       0.54623708       0.52016504 
           0.77147217       0.24480084       0.88319080 
           0.05900280       0.51101535       0.65128334 
           0.01330085       0.20573520       0.76247132 
           0.90274420       0.31040248       0.59207552 
           0.86491737       0.44518932       0.95580964 
           0.13743530       0.32397427       0.73665365 
           0.09695804       0.43557740       0.81802367 
           0.42311639       0.46061063       0.12137184 
           0.36469437       0.29319931       0.42103673 
           0.68915756       0.48499676       0.20907093 
           0.64391553       0.31275702       0.33972473 
           0.32599867       0.31850137       0.00926683 
           0.43557648       0.43806949       0.52288054 
           0.56135350       0.34655774       0.14112241 
           0.69173991       0.42961184       0.40036295 
           0.31841219       0.55425961       0.55239881 
           0.27451713       0.23235172       0.86444640 
           0.60113364       0.51758862       0.65690090 
           0.53861073       0.21041073       0.75090228 
           0.39821304       0.32768713       0.62507829 
           0.36851921       0.42774564       0.91831086 
           0.67273718       0.32688155       0.72780398 
           0.63298162       0.43698602       0.81513166 
           0.65668693       0.69234101       0.62403463 
           0.65962628       0.70551714       0.56268333 
           0.45307093       0.57935593       0.67619336 
   
  
  
           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 
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          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
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    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 
   
  
  
          0.93032549       0.52892219       0.10889721 
          0.85153893       0.23310414       0.42710473 
          0.13657351       0.44849773       0.19559188 
          0.09530048       0.28236361       0.33221540 
          0.81720587       0.33429647       0.02585827 
          0.95684942       0.42165900       0.51720978 
          0.08161169       0.33386241       0.13644279 
          0.20018896       0.40760540       0.39017777 
          0.82997397       0.54623708       0.52016504 
          0.77147217       0.24480084       0.88319080 
          0.05900280       0.51101535       0.65128334 
          0.01330085       0.20573520       0.76247132 
          0.90274420       0.31040248       0.59207552 
          0.86491737       0.44518932       0.95580964 
          0.13743530       0.32397427       0.73665365 
          0.09695804       0.43557740       0.81802367 
          0.42311639       0.46061063       0.12137184 
          0.36469437       0.29319931       0.42103673 
          0.68915756       0.48499676       0.20907093 
          0.64391553       0.31275702       0.33972473 
          0.32599867       0.31850137       0.00926683 
          0.43557648       0.43806949       0.52288054 
          0.56135350       0.34655774       0.14112241 
          0.69173991       0.42961184       0.40036295 
          0.31841219       0.55425961       0.55239881 
          0.27451713       0.23235172       0.86444640 
          0.60113364       0.51758862       0.65690090 
          0.53861073       0.21041073       0.75090228 
          0.39821304       0.32768713       0.62507829 
          0.36851921       0.42774564       0.91831086 
          0.67273718       0.32688155       0.72780398 
          0.63298162       0.43698602       0.81513166 
          0.65668693       0.69234101       0.62403463 
          0.65962628       0.70551714       0.56268333 
          0.45307093       0.57935593       0.67619336 
  
 
 
  
      12.37   12.38
      13.09   13.10
   
         24.76344702 
       9016.52217532 
     -12297.51679940 
       -264.11573761 
       3167.08814863 
      -2605.71786812 
         -0.00949390 
       -197.08660793 
       3755.32434067 
        599.25160468 
        599.26109858 
        599.25476931 
   
  
  
      15.62   15.64
      15.62   15.64
   
        -88.83266754 
        -88.82744703 
        -88.83092737 
   
  
  
      14.71   14.74
      14.72   14.74
   
       -162.19451442 
       -162.16784353 
       -162.18562412 
   
  
  
      15.22   15.24
      15.23   15.24
   
       -165.22575257 
       -165.19785048 
       -165.21645187 
   
  
  
      15.63   15.69
      15.87   15.92
   
       -165.37176071 
       -165.34383972 
       -165.36245371 
   
  
  
      15.37   15.41
      16.90   16.95
   
      -4444.49333457 
      -4444.45871910 
      -4444.48179608 
   
  
  
      13.77   13.81
      14.66   14.70
   
       -123.07217622 
       -123.07954177 
       -123.07463140 
   
  
  
      15.25   15.30
      16.12   16.17
   
       -139.35289465 
       -139.32941901 
       -139.34506944