vasp 
  6.2.1  
  16May21 (build Apr 11 2022 11:03:26) complex                          parallel 
  Lin64 
  2024 09 02 
  02:18:23 
 
 
  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 
    
   
   
           0.92839692       0.52751518       0.10609395 
           0.85065903       0.23320683       0.42826186 
           0.13541505       0.44809557       0.19604671 
           0.09262478       0.28419870       0.33450944 
           0.81866762       0.33165376       0.02707789 
           0.95630302       0.42117594       0.51766589 
           0.08246548       0.33348884       0.13725305 
           0.19903012       0.40569011       0.39009239 
           0.83216955       0.54536681       0.52491722 
           0.77256661       0.24334870       0.88157750 
           0.06265664       0.50976431       0.65302462 
           0.01528121       0.20558250       0.75991095 
           0.90251573       0.31014610       0.59383101 
           0.86391043       0.44237939       0.95479578 
           0.13993565       0.32348701       0.73688199 
           0.09857090       0.43416843       0.81959310 
           0.42135773       0.46191499       0.12164251 
           0.36495841       0.28843758       0.42186664 
           0.69075643       0.48144110       0.20785843 
           0.64266484       0.31365442       0.34243351 
           0.32668212       0.31738846       0.01116207 
           0.43422946       0.43827435       0.52127137 
           0.56338680       0.34845144       0.14274070 
           0.69178354       0.42868086       0.40171202 
           0.31705181       0.55433963       0.54817485 
           0.27410721       0.23169838       0.86529220 
           0.59769774       0.51726766       0.65657714 
           0.53790636       0.20839719       0.75328074 
           0.39649422       0.32924853       0.62217542 
           0.36793458       0.42604311       0.92050515 
           0.66803773       0.32548819       0.72645945 
           0.62949657       0.43584383       0.81507365 
           0.65483647       0.70411674       0.62573811 
           0.66918340       0.71701009       0.55804406 
           0.45572609       0.58170741       0.66835085 
   
  
  
           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
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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 
   
  
  
          0.92839692       0.52751518       0.10609395 
          0.85065903       0.23320683       0.42826186 
          0.13541505       0.44809557       0.19604671 
          0.09262478       0.28419870       0.33450944 
          0.81866762       0.33165376       0.02707789 
          0.95630302       0.42117594       0.51766589 
          0.08246548       0.33348884       0.13725305 
          0.19903012       0.40569011       0.39009239 
          0.83216955       0.54536681       0.52491722 
          0.77256661       0.24334870       0.88157750 
          0.06265664       0.50976431       0.65302462 
          0.01528121       0.20558250       0.75991095 
          0.90251573       0.31014610       0.59383101 
          0.86391043       0.44237939       0.95479578 
          0.13993565       0.32348701       0.73688199 
          0.09857090       0.43416843       0.81959310 
          0.42135773       0.46191499       0.12164251 
          0.36495841       0.28843758       0.42186664 
          0.69075643       0.48144110       0.20785843 
          0.64266484       0.31365442       0.34243351 
          0.32668212       0.31738846       0.01116207 
          0.43422946       0.43827435       0.52127137 
          0.56338680       0.34845144       0.14274070 
          0.69178354       0.42868086       0.40171202 
          0.31705181       0.55433963       0.54817485 
          0.27410721       0.23169838       0.86529220 
          0.59769774       0.51726766       0.65657714 
          0.53790636       0.20839719       0.75328074 
          0.39649422       0.32924853       0.62217542 
          0.36793458       0.42604311       0.92050515 
          0.66803773       0.32548819       0.72645945 
          0.62949657       0.43584383       0.81507365 
          0.65483647       0.70411674       0.62573811 
          0.66918340       0.71701009       0.55804406 
          0.45572609       0.58170741       0.66835085 
  
 
 
  
      14.85   15.01
      15.55   15.71
   
         24.76344702 
       8981.26587211 
     -12262.94979586 
       -264.14683945 
       3167.08814863 
      -2605.71786812 
         -0.00232740 
       -186.67456386 
       3755.32434067 
        608.95041374 
        608.95274114 
        608.95118954 
   
  
  
      18.37   18.37
      18.37   18.37
   
        -87.24441324 
        -87.22258655 
        -87.23713768 
   
  
  
      17.60   17.60
      17.60   17.60
   
       -162.77854613 
       -162.75293425 
       -162.77000884 
   
  
  
      18.29   18.29
      18.29   18.29
   
       -165.85572677 
       -165.82779573 
       -165.84641642 
   
  
  
      19.03   19.03
      19.20   19.20
   
       -165.99598653 
       -165.96794703 
       -165.98664003 
   
  
  
      18.38   18.37
      19.17   19.17
   
      -8240.91950257 
      -8240.90554561 
      -8240.91485025 
   
  
  
      16.71   16.70
      17.47   17.47
   
       -119.64151413 
       -119.62673363 
       -119.63658730