vasp 
  6.2.1  
  16May21 (build Apr 11 2022 11:03:26) complex                          parallel 
  Lin64 
  2024 09 01 
  03:19:42 
 
 
  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 
    
   
   
           0.93073971       0.52883073       0.10895232 
           0.85045941       0.23329459       0.42701380 
           0.13704183       0.44838312       0.19565722 
           0.09403908       0.28280759       0.33256785 
           0.81800027       0.33382088       0.02642391 
           0.95616118       0.42179687       0.51697217 
           0.08173555       0.33391751       0.13677532 
           0.19973401       0.40735740       0.39047675 
           0.82967805       0.54594450       0.52165858 
           0.77165976       0.24456429       0.88270392 
           0.05947559       0.51085271       0.65213199 
           0.01330931       0.20587693       0.76113096 
           0.90266794       0.31051193       0.59202542 
           0.86488396       0.44478214       0.95617532 
           0.13759967       0.32408987       0.73650814 
           0.09775673       0.43538327       0.81868426 
           0.42339578       0.46080370       0.12127360 
           0.36371660       0.29259322       0.42123459 
           0.68969594       0.48480828       0.20907003 
           0.64280293       0.31344470       0.34034730 
           0.32489690       0.31795396       0.00920835 
           0.43560869       0.43820667       0.52209789 
           0.56136636       0.34707912       0.14094421 
           0.69215430       0.42948578       0.40020523 
           0.31867306       0.55501448       0.55212955 
           0.27375447       0.23207542       0.86388743 
           0.59959216       0.51706301       0.65677347 
           0.53822749       0.21024573       0.75115393 
           0.39758613       0.32851811       0.62460800 
           0.36806776       0.42701280       0.91910888 
           0.67173802       0.32676473       0.72752823 
           0.63206303       0.43664964       0.81555340 
           0.65902462       0.69241154       0.62496621 
           0.66497573       0.70628535       0.56068892 
           0.45317823       0.58004159       0.67525508 
   
  
  
           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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          0.50000000       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 
   
  
  
          0.93073971       0.52883073       0.10895232 
          0.85045941       0.23329459       0.42701380 
          0.13704183       0.44838312       0.19565722 
          0.09403908       0.28280759       0.33256785 
          0.81800027       0.33382088       0.02642391 
          0.95616118       0.42179687       0.51697217 
          0.08173555       0.33391751       0.13677532 
          0.19973401       0.40735740       0.39047675 
          0.82967805       0.54594450       0.52165858 
          0.77165976       0.24456429       0.88270392 
          0.05947559       0.51085271       0.65213199 
          0.01330931       0.20587693       0.76113096 
          0.90266794       0.31051193       0.59202542 
          0.86488396       0.44478214       0.95617532 
          0.13759967       0.32408987       0.73650814 
          0.09775673       0.43538327       0.81868426 
          0.42339578       0.46080370       0.12127360 
          0.36371660       0.29259322       0.42123459 
          0.68969594       0.48480828       0.20907003 
          0.64280293       0.31344470       0.34034730 
          0.32489690       0.31795396       0.00920835 
          0.43560869       0.43820667       0.52209789 
          0.56136636       0.34707912       0.14094421 
          0.69215430       0.42948578       0.40020523 
          0.31867306       0.55501448       0.55212955 
          0.27375447       0.23207542       0.86388743 
          0.59959216       0.51706301       0.65677347 
          0.53822749       0.21024573       0.75115393 
          0.39758613       0.32851811       0.62460800 
          0.36806776       0.42701280       0.91910888 
          0.67173802       0.32676473       0.72752823 
          0.63206303       0.43664964       0.81555340 
          0.65902462       0.69241154       0.62496621 
          0.66497573       0.70628535       0.56068892 
          0.45317823       0.58004159       0.67525508 
  
 
 
  
      12.44   12.46
      14.05   14.06
   
         24.76344702 
       9015.52165009 
     -12296.98057779 
       -264.11794044 
       3167.08814863 
      -2605.71786812 
         -0.00751276 
       -196.90547480 
       3755.32434067 
        598.96821251 
        598.97572527 
        598.97071676 
   
  
  
      15.62   15.65
      15.62   15.65
   
        -89.19779688 
        -89.19307957 
        -89.19622444 
   
  
  
      14.84   14.86
      14.84   14.86
   
       -162.55752804 
       -162.53192293 
       -162.54899300 
   
  
  
      15.23   15.27
      15.23   15.27
   
       -165.55626644 
       -165.52910643 
       -165.54721310 
   
  
  
      16.19   16.22
      16.36   16.39
   
       -165.70864672 
       -165.68146180 
       -165.69958508 
   
  
  
      15.57   15.59
      17.11   17.12
   
     -13255.68564061 
     -13255.69436910 
     -13255.68855011 
   
  
  
      13.53   13.55
      14.43   14.45
   
       -114.07837962 
       -114.08228789 
       -114.07968238 
   
  
  
      15.39   15.41
      16.27   16.29
   
       -138.23729328 
       -138.23373805 
       -138.23610820 
   
  
  
      13.19   13.21
      14.07   14.09
   
       -146.49125045 
       -146.45890215 
       -146.48046768 
   
  
  
      15.10   15.12
      15.99   16.01
   
       -135.65469028 
       -135.65298431 
       -135.65412162 
   
  
  
      15.85   15.86
      16.72   16.74
   
       -145.73871001 
       -145.71341511 
       -145.73027838 
   
  
  
      16.12   16.14
      17.02   17.05
   
       -442.55584200 
       -442.52782006 
       -442.54650136 
   
  
  
      13.65   13.68
      14.55   14.57
   
       -139.56300220 
       -139.57735416 
       -139.56778619 
   
  
  
      20.37   20.38
      21.22   21.23
   
     -12033.94965552 
     -12033.95287574 
     -12033.95072893 
   
  
  
      13.28   13.30
      14.16   14.18
   
       -130.06303191 
       -130.07125483 
       -130.06577288 
   
  
  
      15.57   15.59
      16.55   16.57
   
       -149.04750194 
       -149.05321363 
       -149.04940584 
   
  
  
      15.27   15.29
      16.26   16.28
   
       -159.68296225 
       -159.68789506 
       -159.68460652 
   
  
  
      14.21   14.23
      15.10   15.11
   
       -162.34598150 
       -162.34684345 
       -162.34626882 
   
  
  
      14.16   14.18
      15.09   15.11
   
       -168.59007927 
       -168.61322299 
       -168.59779385 
   
  
  
      14.37   14.40
      15.25   15.28
   
       -177.34881169 
       -177.37396476 
       -177.35719605 
   
  
  
      13.22   13.25
      14.21   14.24
   
       -173.93041512 
       -173.95377393 
       -173.93820139 
   
  
  
      13.74   13.76
      14.74   14.77
   
       -172.42838500 
       -172.45305245 
       -172.43660749 
   
  
  
      15.31   15.33
      16.43   16.45
   
       -882.26191394 
       -882.24206658 
       -882.25529816 
   
  
  
      17.07   17.08
      18.13   18.14
   
       -345.68734620 
       -345.68588658 
       -345.68685966 
   
  
  
      14.28   14.31
      15.24   15.27
   
       -166.98216813 
       -166.98552778 
       -166.98328801