vasp 
  6.2.1  
  16May21 (build Apr 11 2022 11:03:26) complex                          parallel 
  Lin64 
  2024 08 31 
  07:22:12 
 
 
  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 
    
   
   
           0.92954267       0.52767204       0.10681462 
           0.85059436       0.23312935       0.42809450 
           0.13539192       0.44796956       0.19648946 
           0.09298037       0.28369604       0.33430856 
           0.81798001       0.33225096       0.02691146 
           0.95715262       0.42134221       0.51821431 
           0.08207659       0.33335582       0.13720614 
           0.19934153       0.40610931       0.39051955 
           0.83270385       0.54523112       0.52306578 
           0.77200024       0.24345204       0.88187795 
           0.06255632       0.51024879       0.65298901 
           0.01501030       0.20543989       0.76066727 
           0.90208552       0.31023191       0.59353071 
           0.86373990       0.44299552       0.95512563 
           0.13909256       0.32335534       0.73696838 
           0.09820087       0.43443887       0.81909312 
           0.42174324       0.46133855       0.12212669 
           0.36465494       0.28988408       0.42146221 
           0.69038887       0.48235402       0.20802822 
           0.64297452       0.31284485       0.34121255 
           0.32701558       0.31732639       0.01116503 
           0.43379936       0.43816348       0.52098435 
           0.56297210       0.34785632       0.14275750 
           0.69268928       0.42909339       0.40138988 
           0.31808631       0.55562924       0.54959514 
           0.27450737       0.23142649       0.86543895 
           0.59887744       0.51636591       0.65477486 
           0.53814716       0.20866024       0.75257344 
           0.39684409       0.32869733       0.62298226 
           0.36794896       0.42621718       0.92014272 
           0.66901848       0.32586080       0.72725854 
           0.63043504       0.43611518       0.81432542 
           0.65426738       0.70381172       0.62270639 
           0.66749934       0.71544999       0.56136184 
           0.45314117       0.58065821       0.66972979 
   
  
  
           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
      104
       -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
  
  
        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 
   
  
  
          0.92954267       0.52767204       0.10681462 
          0.85059436       0.23312935       0.42809450 
          0.13539192       0.44796956       0.19648946 
          0.09298037       0.28369604       0.33430856 
          0.81798001       0.33225096       0.02691146 
          0.95715262       0.42134221       0.51821431 
          0.08207659       0.33335582       0.13720614 
          0.19934153       0.40610931       0.39051955 
          0.83270385       0.54523112       0.52306578 
          0.77200024       0.24345204       0.88187795 
          0.06255632       0.51024879       0.65298901 
          0.01501030       0.20543989       0.76066727 
          0.90208552       0.31023191       0.59353071 
          0.86373990       0.44299552       0.95512563 
          0.13909256       0.32335534       0.73696838 
          0.09820087       0.43443887       0.81909312 
          0.42174324       0.46133855       0.12212669 
          0.36465494       0.28988408       0.42146221 
          0.69038887       0.48235402       0.20802822 
          0.64297452       0.31284485       0.34121255 
          0.32701558       0.31732639       0.01116503 
          0.43379936       0.43816348       0.52098435 
          0.56297210       0.34785632       0.14275750 
          0.69268928       0.42909339       0.40138988 
          0.31808631       0.55562924       0.54959514 
          0.27450737       0.23142649       0.86543895 
          0.59887744       0.51636591       0.65477486 
          0.53814716       0.20866024       0.75257344 
          0.39684409       0.32869733       0.62298226 
          0.36794896       0.42621718       0.92014272 
          0.66901848       0.32586080       0.72725854 
          0.63043504       0.43611518       0.81432542 
          0.65426738       0.70381172       0.62270639 
          0.66749934       0.71544999       0.56136184 
          0.45314117       0.58065821       0.66972979 
  
 
 
  
      14.57   14.70
      15.27   15.41
   
         24.76344702 
       8982.77640864 
     -12263.25620392 
       -264.11266836 
       3167.08814863 
      -2605.71786812 
          0.00115311 
       -187.25626737 
       3755.32434067 
        609.61049030 
        609.60933719 
        609.61010593 
   
  
  
      18.37   18.37
      18.37   18.37
   
        -86.46098902 
        -86.43689575 
        -86.45295793 
   
  
  
      17.57   17.57
      17.57   17.57
   
       -162.18627381 
       -162.16037906 
       -162.17764223 
   
  
  
      18.30   18.30
      18.30   18.30
   
       -165.23452664 
       -165.20667823 
       -165.22524383 
   
  
  
      19.24   19.24
      19.40   19.40
   
       -165.37381573 
       -165.34587194 
       -165.36450114 
   
  
  
      17.02   17.02
      17.82   17.82
   
       -595.31046193 
       -595.29491335 
       -595.30527907 
   
  
  
      16.66   16.66
      17.48   17.48
   
       -124.04888749 
       -124.03959420 
       -124.04578973 
   
  
  
      16.35   16.35
      17.18   17.18
   
       -125.77087357 
       -125.75400513 
       -125.76525076 
   
  
  
      16.72   16.72
      17.54   17.54
   
       -120.90758741 
       -120.89412367 
       -120.90309950 
   
  
  
      16.34   16.33
      17.14   17.14
   
       -129.79593521 
       -129.78684812 
       -129.79290618 
   
  
  
      17.89   17.89
      18.68   18.68
   
       -146.37006444 
       -146.36915654 
       -146.36976181 
   
  
  
      17.60   17.60
      18.42   18.42
   
       -152.35462787 
       -152.35391009 
       -152.35438861 
   
  
  
      16.12   16.12
      16.91   16.91
   
       -153.01843283 
       -153.01805588 
       -153.01830718 
   
  
  
      19.06   19.06
      19.86   19.86
   
       -152.98861422 
       -152.98825968 
       -152.98849604 
   
  
  
      16.61   16.61
      17.40   17.40
   
       -153.01764979 
       -153.01747629 
       -153.01759196 
   
  
  
      15.11   15.10
      15.90   15.90
   
       -150.32641288 
       -150.33191113 
       -150.32824563 
   
  
  
      16.03   16.03
      16.84   16.84
   
       -149.26006724 
       -149.26550935 
       -149.26188128 
   
  
  
      16.60   16.60
      17.43   17.43
   
       -148.67701529 
       -148.68249036 
       -148.67884031 
   
  
  
      15.20   15.20
      16.05   16.05
   
       -149.05450661 
       -149.06017685 
       -149.05639669 
   
  
  
      14.61   14.61
      15.43   15.43
   
       -144.16327044 
       -144.17257586 
       -144.16637224 
   
  
  
      14.63   14.63
      15.52   15.52
   
       -144.53033413 
       -144.53897869 
       -144.53321565 
   
  
  
      15.72   15.72
      16.55   16.55
   
       -131.62068008 
       -131.64051033 
       -131.62729017 
   
  
  
      16.64   16.64
      17.47   17.47
   
       -132.59293457 
       -132.61525406 
       -132.60037440 
   
  
  
      15.48   15.48
      16.31   16.31
   
       -152.08770370 
       -152.08006741 
       -152.08515827 
   
  
  
      21.78   21.78
      22.59   22.58
   
       -427.94115464 
       -427.95304049 
       -427.94511659 
   
  
  
      18.11   18.11
      18.98   18.98
   
       -385.09073738 
       -385.05883513 
       -385.08010330 
   
  
  
      16.65   16.65
      17.53   17.52
   
       -138.20809991 
       -138.19825425 
       -138.20481802 
   
  
  
      16.56   16.56
      17.43   17.43
   
       -142.03230430 
       -142.05914815 
       -142.04125225 
   
  
  
      17.31   17.31
      18.20   18.19
   
       -192.57614341 
       -192.60290109 
       -192.58506264 
   
  
  
      14.43   14.43
      15.31   15.31
   
       -141.54349438 
       -141.57105679 
       -141.55268185