vasp 
  6.2.1  
  16May21 (build Apr 11 2022 11:03:26) complex                          parallel 
  Lin64 
  2024 09 04 
  12:14:59 
 
 
  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
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   F  
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            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 
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            0.00000000       0.00000000       0.09227425 
    
   
   
           0.87570593       0.59008569       0.99129372 
           0.90344677       0.14514130       0.40504699 
           0.98181982       0.44350488       0.01711007 
           0.03313167       0.27140277       0.06913770 
           0.70109401       0.51242799       0.63344926 
           0.89567851       0.56639559       0.40231852 
           0.87947189       0.33987130       0.90775730 
           0.83560925       0.36456293       0.19432940 
           0.76383914       0.59291119       0.68515899 
           0.56681644       0.34181107       0.64036892 
           0.62200159       0.30619387       0.45364309 
           0.92773295       0.25577219       0.71287293 
           0.66799650       0.44145147       0.50169801 
           0.57018188       0.65439870       0.31826954 
           0.99580944       0.59323552       0.54881371 
           0.35783303       0.05823539       0.76027328 
           0.36605581       0.45334132       0.13102913 
           0.27443438       0.23875918       0.17413832 
           0.76188840       0.47421128       0.95779464 
           0.57818740       0.20329596       0.12510338 
           0.14034276       0.36982048       0.92534155 
           0.62793167       0.15542686       0.36653349 
           0.47572077       0.34658333       0.94298590 
           0.33324117       0.31684143       0.93380815 
           0.49787649       0.93154156       0.34208956 
           0.13685825       0.31000929       0.75942534 
           0.49121438       0.50930912       0.82971098 
           0.34620532       0.22037421       0.61541858 
           0.32161428       0.30339221       0.42996914 
           0.40866314       0.41037520       0.90476377 
           0.43900510       0.44319331       0.68654825 
           0.95107357       0.58815235       0.32914405 
           0.33053240       0.48748249       0.01105790 
           0.49016299       0.83601780       0.08381784 
           0.37470226       0.26590819       0.09401199 
           0.26718873       0.47210622       0.66913884 
   
  
  
           1 
           2 
           3 
           4 
           5 
           6 
           7 
           8 
           9 
          10 
          11 
          12 
          13 
          14 
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          17 
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          21 
          22 
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          24 
          25 
          26 
          27 
          28 
          29 
          30 
          31 
          32 
          33 
          34 
          35 
          36 
  
 
 
  
          3        2        2 
         0.00000000       0.00000000       0.00000000 
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          0.00000000       0.50000000       0.50000000 
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          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
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          4
           0.40000000
    
   
   
          0.40000000
          1.00000000
          0.10000000
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          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
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        2
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         0.00010000
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        1
      256
        16.00000000
  
  
        2
         0.00001000
  
  
        0
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      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
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         1.00000000
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         1.00000000
        1
        1
        1
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    F  
        0
        0
    F  
         0.00000000
         0.00000000
        0
  
  
    F  
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         0.12340000
         1.00000000
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        0
        27.21602676
         1.00000000
  
  
    F  
    F  
    F  
    F  
        0
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         0.00000000
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    F  
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    T  
    F  
    F  
    F  
    T  
        0
         0.00000000      0.00000000      0.00000000
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    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
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    F  
       -1
         0.00000000
        0
        0
       -1
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      200
        1
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        4
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        0
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    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 
   
  
  
          0.87570593       0.59008569       0.99129372 
          0.90344677       0.14514130       0.40504699 
          0.98181982       0.44350488       0.01711007 
          0.03313167       0.27140277       0.06913770 
          0.70109401       0.51242799       0.63344926 
          0.89567851       0.56639559       0.40231852 
          0.87947189       0.33987130       0.90775730 
          0.83560925       0.36456293       0.19432940 
          0.76383914       0.59291119       0.68515899 
          0.56681644       0.34181107       0.64036892 
          0.62200159       0.30619387       0.45364309 
          0.92773295       0.25577219       0.71287293 
          0.66799650       0.44145147       0.50169801 
          0.57018188       0.65439870       0.31826954 
          0.99580944       0.59323552       0.54881371 
          0.35783303       0.05823539       0.76027328 
          0.36605581       0.45334132       0.13102913 
          0.27443438       0.23875918       0.17413832 
          0.76188840       0.47421128       0.95779464 
          0.57818740       0.20329596       0.12510338 
          0.14034276       0.36982048       0.92534155 
          0.62793167       0.15542686       0.36653349 
          0.47572077       0.34658333       0.94298590 
          0.33324117       0.31684143       0.93380815 
          0.49787649       0.93154156       0.34208956 
          0.13685825       0.31000929       0.75942534 
          0.49121438       0.50930912       0.82971098 
          0.34620532       0.22037421       0.61541858 
          0.32161428       0.30339221       0.42996914 
          0.40866314       0.41037520       0.90476377 
          0.43900510       0.44319331       0.68654825 
          0.95107357       0.58815235       0.32914405 
          0.33053240       0.48748249       0.01105790 
          0.49016299       0.83601780       0.08381784 
          0.37470226       0.26590819       0.09401199 
          0.26718873       0.47210622       0.66913884 
  
 
 
  
      20.82   20.90
      22.61   22.68
   
         27.86983208 
       3847.46684522 
      -7379.41400790 
       -246.05349219 
       3513.49417245 
      -2953.91778466 
         -0.01523753 
       -248.08342791 
       4187.58753671 
        748.93443628 
        748.94967381 
        748.93951545 
   
  
  
      25.65   25.69
      25.65   25.70
   
         55.82426161 
         55.81731275 
         55.82194532 
   
  
  
      25.97   26.00
      25.97   26.01
   
        -49.49016862 
        -49.50526889 
        -49.49520204 
   
  
  
      27.27   27.33
      27.28   27.34
   
        -55.21203712 
        -55.21757979 
        -55.21388467 
   
  
  
      27.94   28.02
      28.17   28.25
   
        -55.42071642 
        -55.42568229 
        -55.42237171 
   
  
  
      24.07   24.19
      25.33   25.45
   
        -23.47241014 
        -23.51741992 
        -23.48741340 
   
  
  
      22.36   22.49
      23.72   23.85
   
        -19.23322366 
        -19.23401082 
        -19.23348604 
   
  
  
      24.59   24.72
      25.64   25.76
   
         -6.87109591 
         -6.86732892 
         -6.86984025 
   
  
  
      22.32   22.44
      23.45   23.57
   
          1.48172283 
          1.46694950 
          1.47679839 
   
  
  
      23.61   23.73
      24.72   24.84
   
         -3.74343565 
         -3.72789769 
         -3.73825633 
   
  
  
      22.75   22.83
      24.08   24.16
   
         -0.75973370 
         -0.74038328 
         -0.75328356 
   
  
  
      22.67   22.78
      23.76   23.87
   
         -1.62808994 
         -1.65166104 
         -1.63594698 
   
  
  
      22.67   22.76
      23.73   23.82
   
         -3.08441874 
         -3.02565119 
         -3.06482956 
   
  
  
      22.19   22.29
      23.33   23.42
   
         -5.36759758 
         -5.39736922 
         -5.37752146 
   
  
  
      21.92   22.08
      23.02   23.18
   
         -9.65594223 
         -9.64750394 
         -9.65312946 
   
  
  
      23.72   23.86
      24.86   25.00
   
        -11.37388066 
        -11.42088470 
        -11.38954867 
   
  
  
      24.90   24.99
      26.14   26.23
   
        -11.23645058 
        -11.25540178 
        -11.24276765 
   
  
  
      22.74   22.88
      24.15   24.28
   
        -11.31200843 
        -11.29238384 
        -11.30546690 
   
  
  
      21.94   22.09
      23.21   23.36
   
        -11.47845761 
        -11.44481853 
        -11.46724459 
   
  
  
      21.72   21.84
      22.89   23.01
   
        -13.20128773 
        -13.18850635 
        -13.19702727 
   
  
  
      24.10   24.23
      25.15   25.29
   
        -13.16632855 
        -13.15436219 
        -13.16233977 
   
  
  
      22.25   22.37
      23.36   23.47
   
        -13.48991229 
        -13.48101368 
        -13.48694609 
   
  
  
      22.05   22.20
      23.15   23.30
   
        -13.78718746 
        -13.76306090 
        -13.77914527 
   
  
  
      21.91   22.01
      23.03   23.14
   
        -14.90441082 
        -14.86685495 
        -14.89189220 
   
  
  
      21.42   21.54
      22.56   22.69
   
        -15.74238753 
        -15.67386047 
        -15.71954518 
   
  
  
      23.93   24.03
      24.97   25.08
   
        -15.78829286 
        -15.71737159 
        -15.76465244 
   
  
  
      20.98   21.08
      22.28   22.38
   
        -15.29776824 
        -15.21954106 
        -15.27169251 
   
  
  
      20.75   20.87
      21.81   21.93
   
        -14.26249120 
        -14.19411749 
        -14.23969996 
   
  
  
      24.49   24.60
      25.62   25.73
   
        -14.36302287 
        -14.31061431 
        -14.34555335 
   
  
  
      23.02   23.13
      24.15   24.27
   
        -14.43137540 
        -14.40280822 
        -14.42185301 
   
  
  
      20.49   20.62
      21.61   21.73
   
        -14.78734478 
        -14.77124610 
        -14.78197855