vasp 
  6.2.1  
  16May21 (build Apr 11 2022 11:03:26) complex                          parallel 
  Lin64 
  2024 09 03 
  04:00:06 
 
 
  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      0.73000000      0.32000000
        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      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      0.00000000      0.00000000      0.00000000      0.00000000      0.00000000      0.00000000      0.00000000      0.00000000      0.10700000
  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 
    
   
   
           0.31098738       0.50936378       0.29536399 
           0.10159360       0.21951255       0.40025788 
           0.84882810       0.30982009       0.15094000 
           0.59109598       0.78157999       0.68103431 
           0.16722439       0.20877374       0.52886269 
           0.69223829       0.55246318       0.95753986 
           0.76808712       0.26926419       0.91662870 
           0.27855014       0.51937054       0.73475554 
           0.65415922       0.35089584       0.12730583 
           0.54098520       0.06579662       0.70083052 
           0.07551092       0.41905791       0.45319075 
           0.58181168       0.42440290       0.80362287 
           0.07592806       0.76272679       0.40163818 
           0.88399494       0.39715927       0.97864790 
           0.20893457       0.82124435       0.65730155 
           0.39889213       0.59299682       0.40525659 
           0.04219875       0.07666014       0.22654005 
           0.09406546       0.70143901       0.22235094 
           0.12827250       0.97750999       0.02975578 
           0.72849140       0.98714434       0.55433224 
           0.85884462       0.20958724       0.44203105 
           0.70447519       0.71782804       0.67036842 
           0.87926050       0.78289689       0.15827645 
           0.29903396       0.72514533       0.56397300 
           0.62880021       0.23387586       0.95144144 
           0.95468142       0.28147874       0.84672517 
           0.64952273       0.23639656       0.97391131 
           0.84150225       0.00680258       0.77785907 
           0.38332743       0.88540815       0.80158623 
           0.40238844       0.75271698       0.19400072 
           0.71940429       0.69679623       0.85748420 
           0.97757057       0.57830262       0.27211186 
           0.15658725       0.54867235       0.30310161 
           0.23925696       0.07644491       0.49872762 
           0.03360472       0.66185093       0.97336544 
   
  
  
           1 
           2 
           3 
           4 
           5 
           6 
           7 
           8 
           9 
          10 
          11 
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          13 
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          19 
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          21 
          22 
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          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 
          0.50000000       0.00000000       0.00000000 
          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
       88
       -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  
          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      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      0.00000000      0.00000000      0.00000000      0.00000000      0.00000000      0.00000000      0.00000000      0.00000000      0.10700000
         -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
           0.00000003
           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      0.73000000      0.32000000
      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
  
  
        4
        4
       -1
    T  
    F  
    F  
    F  
    F  
    F  
  
  
        3
       -1
    F  
        28.08500000     16.00000000      1.00000000
         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
    O    2
    H    3
    H    3
   
  
  
   type
   atomspertype
   element
   mass
   valence
   pseudopotential
   
      32Si     28.08500000      4.00000000  PAW_PBE Si 05Jan2001                  
       1O      16.00000000      6.00000000  PAW_PBE O 08Apr2002                   
       2H       1.00000000      1.00000000  PAW_PBE H 15Jun2001                   
   
  
 
 
  
   
           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 
   
  
  
          0.31098738       0.50936378       0.29536399 
          0.10159360       0.21951255       0.40025788 
          0.84882810       0.30982009       0.15094000 
          0.59109598       0.78157999       0.68103431 
          0.16722439       0.20877374       0.52886269 
          0.69223829       0.55246318       0.95753986 
          0.76808712       0.26926419       0.91662870 
          0.27855014       0.51937054       0.73475554 
          0.65415922       0.35089584       0.12730583 
          0.54098520       0.06579662       0.70083052 
          0.07551092       0.41905791       0.45319075 
          0.58181168       0.42440290       0.80362287 
          0.07592806       0.76272679       0.40163818 
          0.88399494       0.39715927       0.97864790 
          0.20893457       0.82124435       0.65730155 
          0.39889213       0.59299682       0.40525659 
          0.04219875       0.07666014       0.22654005 
          0.09406546       0.70143901       0.22235094 
          0.12827250       0.97750999       0.02975578 
          0.72849140       0.98714434       0.55433224 
          0.85884462       0.20958724       0.44203105 
          0.70447519       0.71782804       0.67036842 
          0.87926050       0.78289689       0.15827645 
          0.29903396       0.72514533       0.56397300 
          0.62880021       0.23387586       0.95144144 
          0.95468142       0.28147874       0.84672517 
          0.64952273       0.23639656       0.97391131 
          0.84150225       0.00680258       0.77785907 
          0.38332743       0.88540815       0.80158623 
          0.40238844       0.75271698       0.19400072 
          0.71940429       0.69679623       0.85748420 
          0.97757057       0.57830262       0.27211186 
          0.15658725       0.54867235       0.30310161 
          0.23925696       0.07644491       0.49872762 
          0.03360472       0.66185093       0.97336544 
  
 
 
  
       5.11    5.26
       5.57    5.71
   
         24.76344702 
       -806.48851787 
      -1837.59078602 
       -294.82694740 
       3170.77583059 
      -2609.60722799 
          0.00857215 
       -177.12708392 
       3755.32434067 
       1225.23162723 
       1225.22305508 
       1225.22876985 
   
  
  
       7.59    7.65
       7.59    7.66
   
        585.84887498 
        585.85527064 
        585.85100686 
   
  
  
       9.72    9.78
       9.72    9.78
   
        420.46855305 
        420.50492864 
        420.48067825 
   
  
  
       7.83    7.88
       7.83    7.88
   
        398.28005607 
        398.34061054 
        398.30024090 
   
  
  
       7.82    7.87
       7.94    8.00
   
        397.61619451 
        397.67818952 
        397.63685951 
   
  
  
       7.79    7.84
       8.38    8.44
   
        413.71615291 
        413.73335025 
        413.72188536 
   
  
  
       8.53    8.59
       9.10    9.17
   
        438.94024178 
        438.95650672 
        438.94566343 
   
  
  
       7.72    7.78
       8.31    8.36
   
        463.76187665 
        463.74840879 
        463.75738736 
   
  
  
       7.69    7.75
       8.25    8.31
   
        508.89390299 
        508.90835414 
        508.89872004 
   
  
  
       7.33    7.40
       7.90    7.97
   
        505.39653597 
        505.40883697 
        505.40063630 
   
  
  
       7.88    7.94
       8.44    8.51
   
        505.34429836 
        505.36956497 
        505.35272056 
   
  
  
       7.19    7.25
       7.75    7.82
   
        506.80565566 
        506.80711480 
        506.80614204 
   
  
  
       8.16    8.22
       8.73    8.79
   
        503.71263154 
        503.68166397 
        503.70230902 
   
  
  
       7.15    7.21
       7.72    7.78
   
        508.73933147 
        508.78341972 
        508.75402755