vasp 
  6.2.1  
  16May21 (build Apr 11 2022 11:03:26) complex                          parallel 
  Lin64 
  2024 08 31 
  04:00:07 
 
 
  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 
    
   
   
           0.92355402       0.52800981       0.10483909 
           0.85585492       0.23451452       0.42977276 
           0.13375740       0.44997357       0.19670605 
           0.09728506       0.28747267       0.33710588 
           0.82253942       0.33198358       0.02709614 
           0.95740971       0.42211538       0.51799019 
           0.08506868       0.33494505       0.13826555 
           0.19877278       0.40546708       0.38943103 
           0.83261482       0.54688212       0.52432923 
           0.77508512       0.24426750       0.88149220 
           0.06045509       0.51029835       0.65363900 
           0.02068002       0.20694564       0.76201539 
           0.90401117       0.31149856       0.59566015 
           0.86441930       0.44254714       0.95294457 
           0.14382202       0.32450307       0.73673239 
           0.10068377       0.43472506       0.82003326 
           0.41572752       0.47008305       0.12021140 
           0.37258392       0.28165494       0.42371147 
           0.68889484       0.47705241       0.20464535 
           0.64625305       0.31526592       0.34580508 
           0.33096626       0.32095374       0.01385996 
           0.43513597       0.43636485       0.52040997 
           0.56994045       0.35223311       0.14516028 
           0.69346997       0.42910233       0.40251805 
           0.31231428       0.55136535       0.54242281 
           0.27780844       0.23435638       0.86882630 
           0.59519059       0.52019472       0.65359510 
           0.53876683       0.20924117       0.75554129 
           0.39909160       0.32810731       0.62064333 
           0.36886383       0.42891256       0.92169270 
           0.66812306       0.32712827       0.72758763 
           0.62786960       0.43888520       0.81368376 
           0.64961253       0.69106504       0.62620978 
           0.63958388       0.69798561       0.56355264 
           0.44925031       0.58257107       0.65376244 
   
  
  
           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 
   
  
  
          0.92355402       0.52800981       0.10483909 
          0.85585492       0.23451452       0.42977276 
          0.13375740       0.44997357       0.19670605 
          0.09728506       0.28747267       0.33710588 
          0.82253942       0.33198358       0.02709614 
          0.95740971       0.42211538       0.51799019 
          0.08506868       0.33494505       0.13826555 
          0.19877278       0.40546708       0.38943103 
          0.83261482       0.54688212       0.52432923 
          0.77508512       0.24426750       0.88149220 
          0.06045509       0.51029835       0.65363900 
          0.02068002       0.20694564       0.76201539 
          0.90401117       0.31149856       0.59566015 
          0.86441930       0.44254714       0.95294457 
          0.14382202       0.32450307       0.73673239 
          0.10068377       0.43472506       0.82003326 
          0.41572752       0.47008305       0.12021140 
          0.37258392       0.28165494       0.42371147 
          0.68889484       0.47705241       0.20464535 
          0.64625305       0.31526592       0.34580508 
          0.33096626       0.32095374       0.01385996 
          0.43513597       0.43636485       0.52040997 
          0.56994045       0.35223311       0.14516028 
          0.69346997       0.42910233       0.40251805 
          0.31231428       0.55136535       0.54242281 
          0.27780844       0.23435638       0.86882630 
          0.59519059       0.52019472       0.65359510 
          0.53876683       0.20924117       0.75554129 
          0.39909160       0.32810731       0.62064333 
          0.36886383       0.42891256       0.92169270 
          0.66812306       0.32712827       0.72758763 
          0.62786960       0.43888520       0.81368376 
          0.64961253       0.69106504       0.62620978 
          0.63958388       0.69798561       0.56355264 
          0.44925031       0.58257107       0.65376244 
  
 
 
  
      12.38   12.40
      13.58   13.60
   
         24.76344702 
       9041.63983853 
     -12319.49705932 
       -263.93515651 
       3167.08814863 
      -2605.71786812 
         -0.00559169 
       -198.16547708 
       3755.32434067 
        601.49462215 
        601.50021383 
        601.49648604 
   
  
  
      15.53   15.54
      15.53   15.54
   
        -88.16370832 
        -88.16109105 
        -88.16283590 
   
  
  
      14.71   14.76
      14.71   14.76
   
       -161.93805297 
       -161.91990776 
       -161.93200456 
   
  
  
      15.27   15.31
      15.27   15.31
   
       -164.98356685 
       -164.96406610 
       -164.97706660 
   
  
  
      15.89   15.93
      16.08   16.12
   
       -165.13277843 
       -165.11323166 
       -165.12626284 
   
  
  
      12.45   12.52
      13.47   13.54
   
       -138.18309473 
       -138.17713496 
       -138.18110814 
   
  
  
      15.08   15.11
      15.89   15.93
   
       -934.08838079 
       -934.05871370 
       -934.07849176 
   
  
  
      15.02   15.07
      16.06   16.11
   
       -125.42962027 
       -125.43114664 
       -125.43012906 
   
  
  
      15.59   15.65
      16.46   16.52
   
       -141.85580722 
       -141.83713943 
       -141.84958463 
   
  
  
      14.32   14.37
      15.13   15.17
   
       -145.88687610 
       -145.86509836 
       -145.87961685 
   
  
  
      14.00   14.04
      14.78   14.83
   
       -149.80527333 
       -149.78583129 
       -149.79879265 
   
  
  
      14.10   14.15
      14.91   14.96
   
       -156.83559124 
       -156.83631023 
       -156.83583090 
   
  
  
      13.83   13.90
      14.63   14.70
   
       -166.46943539 
       -166.47174305 
       -166.47020461 
   
  
  
      13.79   13.83
      14.59   14.63
   
       -167.24567730 
       -167.26571607 
       -167.25235689 
   
  
  
      20.62   20.67
      21.44   21.48
   
     -39650.05420133 
     -39650.05174042 
     -39650.05338103 
   
  
  
      12.37   12.41
      13.27   13.31
   
       -126.80376192 
       -126.80757145 
       -126.80503176 
   
  
  
      18.04   18.09
      18.88   18.93
   
      -1153.06897042 
      -1153.06601736 
      -1153.06798607 
   
  
  
      14.16   14.20
      15.09   15.13
   
       -156.66410250 
       -156.65242293 
       -156.66020931 
   
  
  
      14.73   14.77
      15.70   15.74
   
       -169.83806432 
       -169.87059550 
       -169.84890805