vasp 
  6.2.1  
  16May21 (build Apr 11 2022 11:03:26) complex                          parallel 
  Lin64 
  2024 09 04 
  20:47:22 
 
 
  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
  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 
    
   
   
           0.82118709       0.56438365       0.06005739 
           0.83232765       0.26967487       0.31510927 
           0.99782135       0.45989890       0.13131741 
           0.12434879       0.32252745       0.25654384 
           0.73671671       0.25960010       0.02676605 
           0.81464851       0.48711786       0.43247972 
           0.01539216       0.32741269       0.06597194 
           0.06584104       0.44646679       0.33252744 
           0.92773474       0.60256342       0.52335257 
           0.67301225       0.22602160       0.77781193 
           0.05007710       0.43719985       0.52441858 
           0.91631122       0.18045660       0.65724993 
           0.83391697       0.37646103       0.48800761 
           0.84409583       0.38862891       0.02874531 
           0.02710574       0.30753346       0.64782944 
           0.98373700       0.39395754       0.80756432 
           0.30814214       0.45181039       0.08548437 
           0.29939805       0.25855539       0.36015736 
           0.64687249       0.45541117       0.11222134 
           0.51659213       0.30210659       0.25830312 
           0.22789822       0.31755517       0.91103822 
           0.37131490       0.51585957       0.38341653 
           0.42853474       0.33522211       0.07341033 
           0.66973540       0.38350051       0.26672216 
           0.59317806       0.57803204       0.72698981 
           0.16261947       0.22031613       0.78055408 
           0.94137904       0.40006562       0.77587590 
           0.42629971       0.17801731       0.66748803 
           0.26315262       0.37771178       0.49912174 
           0.30373956       0.43313155       0.85478713 
           0.57575739       0.30052896       0.58677933 
           0.69156131       0.34586844       0.86605762 
           0.63322584       0.88545173       0.17729251 
           0.88552169       0.53272486       0.78495878 
           0.88017796       0.94138997       0.35293730 
           0.70168909       0.55038206       0.95402165 
   
  
  
           1 
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           8 
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          11 
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          25 
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          28 
          29 
          30 
          31 
          32 
          33 
          34 
          35 
          36 
  
 
 
  
          3        2        2 
         0.00000000       0.00000000       0.00000000 
         0.33333333       0.00000000       0.00000000 
         0.00000000       0.50000000       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       0.50000000       0.00000000 
          0.33333333       0.50000000       0.00000000 
          0.00000000       0.00000000       0.50000000 
          0.33333333       0.00000000       0.50000000 
          0.00000000       0.50000000       0.50000000 
          0.33333333       0.50000000       0.50000000 
  
  
          0.08333333 
          0.16666667 
          0.08333333 
          0.16666667 
          0.08333333 
          0.16666667 
          0.08333333 
          0.16666667 
  
 
 
  
   No title
    F  
  
  
   normal
       400.00000000
       605.39200000
         0.00001000
       38
       10
      108
       -1
       -1
       142.00000000
        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
         -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      0.73000000      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
  
  
        3
        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
        27.21602676
         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  
  
 
 
        36 
         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
    O    2
    H    3
    H    3
   
  
  
   type
   atomspertype
   element
   mass
   valence
   pseudopotential
   
      32Si     28.08500000      4.00000000  PAW_PBE Si 05Jan2001                  
       2O      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 
   
  
  
          0.82118709       0.56438365       0.06005739 
          0.83232765       0.26967487       0.31510927 
          0.99782135       0.45989890       0.13131741 
          0.12434879       0.32252745       0.25654384 
          0.73671671       0.25960010       0.02676605 
          0.81464851       0.48711786       0.43247972 
          0.01539216       0.32741269       0.06597194 
          0.06584104       0.44646679       0.33252744 
          0.92773474       0.60256342       0.52335257 
          0.67301225       0.22602160       0.77781193 
          0.05007710       0.43719985       0.52441858 
          0.91631122       0.18045660       0.65724993 
          0.83391697       0.37646103       0.48800761 
          0.84409583       0.38862891       0.02874531 
          0.02710574       0.30753346       0.64782944 
          0.98373700       0.39395754       0.80756432 
          0.30814214       0.45181039       0.08548437 
          0.29939805       0.25855539       0.36015736 
          0.64687249       0.45541117       0.11222134 
          0.51659213       0.30210659       0.25830312 
          0.22789822       0.31755517       0.91103822 
          0.37131490       0.51585957       0.38341653 
          0.42853474       0.33522211       0.07341033 
          0.66973540       0.38350051       0.26672216 
          0.59317806       0.57803204       0.72698981 
          0.16261947       0.22031613       0.78055408 
          0.94137904       0.40006562       0.77587590 
          0.42629971       0.17801731       0.66748803 
          0.26315262       0.37771178       0.49912174 
          0.30373956       0.43313155       0.85478713 
          0.57575739       0.30052896       0.58677933 
          0.69156131       0.34586844       0.86605762 
          0.63322584       0.88545173       0.17729251 
          0.88552169       0.53272486       0.78495878 
          0.88017796       0.94138997       0.35293730 
          0.70168909       0.55038206       0.95402165 
  
 
 
  
      20.80   20.86
      22.87   22.94
   
         27.86983208 
       7688.85891158 
     -11090.02650138 
       -244.24819568 
       3513.49417245 
      -2953.91778466 
          0.00690322 
       -198.27131723 
       4187.58753671 
        931.35355710 
        931.34665388 
        931.35125603 
   
  
  
      26.21   26.26
      26.21   26.27
   
        222.19728726 
        222.19882349 
        222.19779934 
   
  
  
      27.32   27.40
      27.32   27.40
   
        115.61441823 
        115.59605672 
        115.60829772 
   
  
  
      27.82   27.94
      27.83   27.95
   
        106.21822009 
        106.19973478 
        106.21205832 
   
  
  
      26.72   26.84
      26.95   27.08
   
        105.89939255 
        105.88177342 
        105.89351951 
   
  
  
      27.68   27.81
      28.72   28.85
   
        117.55858519 
        117.54837254 
        117.55518097 
   
  
  
      25.41   25.56
      26.49   26.64
   
         59.67232282 
         59.68893222 
         59.67785929 
   
  
  
      22.39   22.47
      23.48   23.56
   
        118.38333685 
        118.38731768 
        118.38466379 
   
  
  
      24.39   24.46
      25.50   25.57
   
        120.65744353 
        120.65908753 
        120.65799153 
   
  
  
      24.35   24.45
      25.45   25.55
   
        126.41837443 
        126.41410506 
        126.41695131 
   
  
  
      23.16   23.25
      24.19   24.28
   
        139.07185636 
        139.07528321 
        139.07299865 
   
  
  
      23.44   23.53
      24.53   24.61
   
        136.46081322 
        136.46604142 
        136.46255595 
   
  
  
      27.16   27.26
      28.24   28.34
   
        146.00506607 
        146.00406890 
        146.00473368 
   
  
  
      24.69   24.83
      25.75   25.89
   
        122.08260227 
        122.06059694 
        122.07526716 
   
  
  
      21.58   21.72
      22.68   22.83
   
        134.20258602 
        134.19511380 
        134.20009528