vasp 
  6.2.1  
  16May21 (build Apr 11 2022 11:03:26) complex                          parallel 
  Lin64 
  2024 09 01 
  22:41:03 
 
 
  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 
    
   
   
           0.89797030       0.52172055       0.10606832 
           0.88013265       0.24231895       0.43405710 
           0.14715692       0.46477819       0.18168663 
           0.13114465       0.29141307       0.34560872 
           0.84491288       0.33060866       0.02715414 
           0.95515786       0.42346936       0.51437248 
           0.09940440       0.33783463       0.15025906 
           0.18579043       0.41399992       0.37186989 
           0.82852215       0.54761109       0.53477945 
           0.78535833       0.24753176       0.87354284 
           0.07645508       0.51167350       0.63965934 
           0.04278156       0.21222108       0.76471364 
           0.90592822       0.31597114       0.60585715 
           0.87633769       0.44180507       0.94634863 
           0.16495241       0.32951323       0.73147117 
           0.11962806       0.44139837       0.81441017 
           0.40371349       0.51619383       0.11583853 
           0.38929691       0.24866189       0.43668738 
           0.65800678       0.46374822       0.19299319 
           0.63493950       0.29981585       0.35465592 
           0.34933442       0.33594785       0.02784835 
           0.42823696       0.43482006       0.49975875 
           0.60303175       0.34168766       0.15488665 
           0.69978754       0.45394097       0.40572218 
           0.35943752       0.54118353       0.58124731 
           0.28431197       0.24756872       0.88306708 
           0.61610018       0.54307228       0.69861159 
           0.53581460       0.21651797       0.76544119 
           0.40987941       0.32714487       0.60067543 
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           0.66056090       0.33476895       0.72912594 
           0.62690500       0.44310684       0.82297744 
           0.64301670       0.60455774       0.78400536 
           0.48646861       0.62932790       0.47349565 
           0.35312303       0.60673727       0.48309616 
   
  
  
           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 
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         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
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         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 
   
  
  
          0.89797030       0.52172055       0.10606832 
          0.88013265       0.24231895       0.43405710 
          0.14715692       0.46477819       0.18168663 
          0.13114465       0.29141307       0.34560872 
          0.84491288       0.33060866       0.02715414 
          0.95515786       0.42346936       0.51437248 
          0.09940440       0.33783463       0.15025906 
          0.18579043       0.41399992       0.37186989 
          0.82852215       0.54761109       0.53477945 
          0.78535833       0.24753176       0.87354284 
          0.07645508       0.51167350       0.63965934 
          0.04278156       0.21222108       0.76471364 
          0.90592822       0.31597114       0.60585715 
          0.87633769       0.44180507       0.94634863 
          0.16495241       0.32951323       0.73147117 
          0.11962806       0.44139837       0.81441017 
          0.40371349       0.51619383       0.11583853 
          0.38929691       0.24866189       0.43668738 
          0.65800678       0.46374822       0.19299319 
          0.63493950       0.29981585       0.35465592 
          0.34933442       0.33594785       0.02784835 
          0.42823696       0.43482006       0.49975875 
          0.60303175       0.34168766       0.15488665 
          0.69978754       0.45394097       0.40572218 
          0.35943752       0.54118353       0.58124731 
          0.28431197       0.24756872       0.88306708 
          0.61610018       0.54307228       0.69861159 
          0.53581460       0.21651797       0.76544119 
          0.40987941       0.32714487       0.60067543 
          0.37186140       0.44600119       0.93989941 
          0.66056090       0.33476895       0.72912594 
          0.62690500       0.44310684       0.82297744 
          0.64301670       0.60455774       0.78400536 
          0.48646861       0.62932790       0.47349565 
          0.35312303       0.60673727       0.48309616 
  
 
 
  
      12.31   12.33
      13.96   13.98
   
         24.76344702 
       8710.75543227 
     -12002.75658676 
       -265.24715031 
       3167.08814863 
      -2605.71786812 
         -0.00849585 
       -197.49128964 
       3755.32434067 
        586.70997792 
        586.71847377 
        586.71280987 
   
  
  
      15.80   15.82
      15.80   15.82
   
        -95.43755981 
        -95.43610344 
        -95.43707435 
   
  
  
      14.81   14.85
      14.82   14.85
   
       -166.32789551 
       -166.33781039 
       -166.33120047 
   
  
  
      15.54   15.58
      15.54   15.59
   
       -168.85238470 
       -168.86364425 
       -168.85613789 
   
  
  
      16.73   16.78
      17.05   17.10
   
       -168.98511942 
       -168.99636499 
       -168.98886795 
   
  
  
      13.41   13.48
      14.75   14.83
   
       -145.60226431 
       -145.62402367 
       -145.60951743 
   
  
  
      13.81   13.84
      14.87   14.91
   
       -145.17834831 
       -145.21616945 
       -145.19095536 
   
  
  
      14.97   15.03
      15.84   15.91
   
       -145.73972163 
       -145.77690940 
       -145.75211756 
   
  
  
      14.50   14.54
      15.37   15.42
   
       -151.00119360 
       -151.03400961 
       -151.01213227 
   
  
  
      14.21   14.26
      15.14   15.20
   
       -154.16059338 
       -154.18227586 
       -154.16782088 
   
  
  
      13.85   13.91
      14.78   14.84
   
       -164.29637473 
       -164.28022444 
       -164.29099130 
   
  
  
      13.74   13.80
      14.55   14.61
   
       -168.14321404 
       -168.12840229 
       -168.13827679 
   
  
  
      13.49   13.53
      14.30   14.34
   
       -170.67032255 
       -170.65737603 
       -170.66600705 
   
  
  
      13.99   14.03
      14.77   14.81
   
       -172.05248156 
       -172.05234144 
       -172.05243485 
   
  
  
      14.00   14.06
      14.93   15.00
   
       -172.79560815 
       -172.80866804 
       -172.79996144 
   
  
  
      13.70   13.73
      14.55   14.58
   
       -173.27384469 
       -173.28902449 
       -173.27890462 
   
  
  
      14.24   14.27
      15.28   15.31
   
       -173.56147371 
       -173.57777085 
       -173.56690609 
   
  
  
      14.42   14.46
      15.43   15.47
   
       -173.71859311 
       -173.73518420 
       -173.72412347 
   
  
  
      13.87   13.91
      14.75   14.79
   
       -173.80933465 
       -173.82603604 
       -173.81490178