vasp 
  6.2.1  
  16May21 (build Apr 11 2022 11:03:26) complex                          parallel 
  Lin64 
  2024 09 02 
  01:16:26 
 
 
  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 
    
   
   
           0.92775628       0.52720605       0.10611299 
           0.85082312       0.23329076       0.42828713 
           0.13595741       0.44826698       0.19525530 
           0.09290536       0.28406387       0.33430544 
           0.81930456       0.33144171       0.02713770 
           0.95583213       0.42101755       0.51740940 
           0.08270159       0.33348775       0.13744606 
           0.19849603       0.40602958       0.38956660 
           0.83153564       0.54533458       0.52593111 
           0.77266942       0.24329193       0.88142211 
           0.06242542       0.50936674       0.65308387 
           0.01518315       0.20560423       0.75951649 
           0.90271276       0.31007978       0.59396901 
           0.86411572       0.44213809       0.95470129 
           0.14037887       0.32355917       0.73673594 
           0.09908341       0.43408733       0.81986350 
           0.42156907       0.46274917       0.12126384 
           0.36441731       0.28763046       0.42221005 
           0.69020121       0.48113071       0.20774096 
           0.64174805       0.31353255       0.34295208 
           0.32630017       0.31734801       0.01129832 
           0.43408527       0.43828457       0.52084077 
           0.56358564       0.34762691       0.14257073 
           0.69154638       0.42912221       0.40177190 
           0.31878699       0.55381932       0.54941443 
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           0.59863681       0.51762307       0.65863628 
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           0.62906549       0.43545905       0.81550220 
           0.65588716       0.70532922       0.62301657 
           0.67014149       0.71750079       0.56046975 
           0.45458587       0.58240488       0.66608828 
   
  
  
           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 
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          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
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         0.50000000
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         0.00010000
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        1
        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
  
  
        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
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        1
        1
        1
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    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 
   
  
  
          0.92775628       0.52720605       0.10611299 
          0.85082312       0.23329076       0.42828713 
          0.13595741       0.44826698       0.19525530 
          0.09290536       0.28406387       0.33430544 
          0.81930456       0.33144171       0.02713770 
          0.95583213       0.42101755       0.51740940 
          0.08270159       0.33348775       0.13744606 
          0.19849603       0.40602958       0.38956660 
          0.83153564       0.54533458       0.52593111 
          0.77266942       0.24329193       0.88142211 
          0.06242542       0.50936674       0.65308387 
          0.01518315       0.20560423       0.75951649 
          0.90271276       0.31007978       0.59396901 
          0.86411572       0.44213809       0.95470129 
          0.14037887       0.32355917       0.73673594 
          0.09908341       0.43408733       0.81986350 
          0.42156907       0.46274917       0.12126384 
          0.36441731       0.28763046       0.42221005 
          0.69020121       0.48113071       0.20774096 
          0.64174805       0.31353255       0.34295208 
          0.32630017       0.31734801       0.01129832 
          0.43408527       0.43828457       0.52084077 
          0.56358564       0.34762691       0.14257073 
          0.69154638       0.42912221       0.40177190 
          0.31878699       0.55381932       0.54941443 
          0.27367888       0.23184505       0.86515438 
          0.59863681       0.51762307       0.65863628 
          0.53775878       0.20831286       0.75358156 
          0.39635557       0.32941513       0.62150915 
          0.36780707       0.42600061       0.92110147 
          0.66742220       0.32527146       0.72602553 
          0.62906549       0.43545905       0.81550220 
          0.65588716       0.70532922       0.62301657 
          0.67014149       0.71750079       0.56046975 
          0.45458587       0.58240488       0.66608828 
  
 
 
  
      14.84   15.03
      15.54   15.73
   
         24.76344702 
       8975.24473927 
     -12255.10987188 
       -264.07549110 
       3167.08814863 
      -2605.71786812 
         -0.00195388 
       -187.53640209 
       3755.32434067 
        609.97908853 
        609.98104240 
        609.97973982 
   
  
  
      18.38   18.38
      18.38   18.38
   
        -86.59416049 
        -86.57061406 
        -86.58631168 
   
  
  
      17.67   17.67
      17.68   17.67
   
       -162.31936548 
       -162.29320275 
       -162.31064457 
   
  
  
      18.21   18.21
      18.21   18.21
   
       -165.38167049 
       -165.35287644 
       -165.37207247 
   
  
  
      19.22   19.21
      19.43   19.43
   
       -165.52567574 
       -165.49671833 
       -165.51602327 
   
  
  
      16.14   16.14
      16.96   16.96
   
       -161.33550079 
       -161.30572490 
       -161.32557549 
   
  
  
      17.84   17.84
      18.66   18.66
   
      -2481.21934498 
      -2481.19431943 
      -2481.21100313 
   
  
  
      18.34   18.34
      19.18   19.18
   
       -139.55163013 
       -139.52470622 
       -139.54265550 
   
  
  
      16.54   16.54
      17.34   17.34
   
       -134.46697357 
       -134.44191694 
       -134.45862136 
   
  
  
      17.11   17.11
      17.94   17.94
   
       -141.29285903 
       -141.27209980 
       -141.28593928 
   
  
  
      16.19   16.19
      16.99   16.99
   
       -145.05361841 
       -145.04505266 
       -145.05076316 
   
  
  
      15.89   15.89
      16.71   16.71
   
       -153.09802162 
       -153.10687667 
       -153.10097331 
   
  
  
      15.96   15.96
      16.77   16.77
   
       -158.80918788 
       -158.81791939 
       -158.81209838 
   
  
  
      18.47   18.46
      19.30   19.30
   
      -3814.85014844 
      -3814.86102332 
      -3814.85377340 
   
  
  
      21.18   21.17
      21.98   21.98
   
     -19488.34171135 
     -19488.33845424 
     -19488.34062565 
   
  
  
      16.69   16.69
      17.50   17.50
   
       -126.59864095 
       -126.58406657 
       -126.59378283 
   
  
  
      21.22   21.22
      22.01   22.01
   
      -2650.60712522 
      -2650.59151764 
      -2650.60192269 
   
  
  
      16.98   16.98
      17.81   17.81
   
       -151.95855782 
       -151.96906718 
       -151.96206094 
   
  
  
      17.41   17.41
      18.23   18.23
   
       -165.53964981 
       -165.55235049 
       -165.54388337 
   
  
  
      17.06   17.06
      17.87   17.87
   
       -169.35958123 
       -169.38307636 
       -169.36741294 
   
  
  
      17.60   17.60
      18.42   18.42
   
       -171.74504789 
       -171.77363696 
       -171.75457758 
   
  
  
      18.56   18.56
      19.39   19.39
   
       -203.14315105 
       -203.13913108 
       -203.14181106 
   
  
  
      16.55   16.55
      17.38   17.38
   
       -168.34154379 
       -168.36569184 
       -168.34959314 
   
  
  
      16.93   16.93
      17.77   17.77
   
       -183.27276186 
       -183.29712411 
       -183.28088261 
   
  
  
      16.32   16.32
      17.16   17.16
   
       -166.96469945 
       -166.99638255 
       -166.97526048 
   
  
  
      16.06   16.07
      16.90   16.90
   
       -168.89167849 
       -168.91577351 
       -168.89971016 
   
  
  
      19.41   19.41
      20.30   20.30
   
       -177.50462166 
       -177.52904375 
       -177.51276235 
   
  
  
      14.63   14.63
      15.47   15.47
   
       -173.76314144 
       -173.78779302 
       -173.77135864 
   
  
  
      14.41   14.41
      15.25   15.25
   
       -172.54886288 
       -172.57357884 
       -172.55710153 
   
  
  
      14.20   14.20
      15.10   15.10
   
       -174.26564512 
       -174.29027230 
       -174.27385418 
   
  
  
      13.55   13.55
      14.44   14.44
   
       -174.35973009 
       -174.38396488 
       -174.36780835 
   
  
  
      14.85   14.85
      15.72   15.72
   
       -203.69762594 
       -203.68766072 
       -203.69430420 
   
  
  
       7.32    7.32
       8.21    8.21
   
       -169.47798145 
       -169.46205581 
       -169.47267290 
   
  
  
       3.95    3.95
       4.82    4.82
   
       -167.73168641 
       -167.73994494 
       -167.73443925 
   
  
  
       1.24    1.24
       2.10    2.10
   
       -167.34829846 
       -167.37386881 
       -167.35682191 
   
  
  
       1.25    1.25
       2.11    2.11
   
       -171.93044759 
       -171.95422710 
       -171.93837410 
   
  
  
       1.29    1.29
       2.14    2.14
   
       -175.89214204 
       -175.91555993 
       -175.89994800 
   
  
  
       1.26    1.26
       2.10    2.11
   
       -175.89551677 
       -175.91938092 
       -175.90347149 
   
  
  
       1.25    1.25
       2.10    2.10
   
       -174.76595471 
       -174.79005797 
       -174.77398913