vasp 
  6.2.1  
  16May21 (build Apr 11 2022 11:03:26) complex                          parallel 
  Lin64 
  2024 09 02 
  15:39:41 
 
 
  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 
    
   
   
           0.92803182       0.52791620       0.10778076 
           0.85268302       0.23328553       0.42845914 
           0.13563645       0.44844222       0.19539919 
           0.09527837       0.28349728       0.33366678 
           0.81882312       0.33316330       0.02649962 
           0.95708004       0.42164108       0.51815891 
           0.08250724       0.33368179       0.13715943 
           0.19861076       0.40682375       0.38980733 
           0.83165609       0.54558912       0.52121615 
           0.77221648       0.24412446       0.88247842 
           0.06081439       0.51066311       0.65268104 
           0.01584159       0.20570712       0.76244854 
           0.90253189       0.31057272       0.59363525 
           0.86450262       0.44388873       0.95453133 
           0.13947873       0.32364447       0.73681195 
           0.09901396       0.43485084       0.81880591 
           0.42069171       0.46311276       0.12122116 
           0.36582176       0.28978108       0.42188230 
           0.68876097       0.48234756       0.20770255 
           0.64398682       0.31315597       0.34213837 
           0.32694136       0.31849387       0.01101063 
           0.43500450       0.43762417       0.52084885 
           0.56360906       0.34782594       0.14269586 
           0.69292779       0.42959705       0.40105568 
           0.31701755       0.55399275       0.54920807 
           0.27547117       0.23225364       0.86626712 
           0.59876360       0.51760912       0.65500135 
           0.53812116       0.20953060       0.75226747 
           0.39776812       0.32809577       0.62345213 
           0.36853747       0.42736429       0.92012531 
           0.66998759       0.32652903       0.72778765 
           0.63054599       0.43693148       0.81451737 
           0.65357843       0.69678463       0.62757533 
           0.66029648       0.70950446       0.55809971 
           0.45292212       0.58064626       0.66949555 
   
  
  
           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 
   
  
  
          0.92803182       0.52791620       0.10778076 
          0.85268302       0.23328553       0.42845914 
          0.13563645       0.44844222       0.19539919 
          0.09527837       0.28349728       0.33366678 
          0.81882312       0.33316330       0.02649962 
          0.95708004       0.42164108       0.51815891 
          0.08250724       0.33368179       0.13715943 
          0.19861076       0.40682375       0.38980733 
          0.83165609       0.54558912       0.52121615 
          0.77221648       0.24412446       0.88247842 
          0.06081439       0.51066311       0.65268104 
          0.01584159       0.20570712       0.76244854 
          0.90253189       0.31057272       0.59363525 
          0.86450262       0.44388873       0.95453133 
          0.13947873       0.32364447       0.73681195 
          0.09901396       0.43485084       0.81880591 
          0.42069171       0.46311276       0.12122116 
          0.36582176       0.28978108       0.42188230 
          0.68876097       0.48234756       0.20770255 
          0.64398682       0.31315597       0.34213837 
          0.32694136       0.31849387       0.01101063 
          0.43500450       0.43762417       0.52084885 
          0.56360906       0.34782594       0.14269586 
          0.69292779       0.42959705       0.40105568 
          0.31701755       0.55399275       0.54920807 
          0.27547117       0.23225364       0.86626712 
          0.59876360       0.51760912       0.65500135 
          0.53812116       0.20953060       0.75226747 
          0.39776812       0.32809577       0.62345213 
          0.36853747       0.42736429       0.92012531 
          0.66998759       0.32652903       0.72778765 
          0.63054599       0.43693148       0.81451737 
          0.65357843       0.69678463       0.62757533 
          0.66029648       0.70950446       0.55809971 
          0.45292212       0.58064626       0.66949555 
  
 
 
  
      14.80   14.96
      15.51   15.67
   
         24.76344702 
       9001.23888344 
     -12283.14233539 
       -264.15945968 
       3167.08814863 
      -2605.71786812 
          0.00208343 
       -186.49079382 
       3755.32434067 
        608.90644618 
        608.90436275 
        608.90575170 
   
  
  
      18.42   18.42
      18.42   18.42
   
        -87.36992528 
        -87.33935952 
        -87.35973669 
   
  
  
      17.71   17.71
      17.71   17.71
   
       -162.86514625 
       -162.84019661 
       -162.85682970 
   
  
  
      18.40   18.39
      18.40   18.39
   
       -165.89962048 
       -165.87269457 
       -165.89064517 
   
  
  
      18.92   18.91
      19.06   19.05
   
       -166.03308288 
       -166.00603900 
       -166.02406826 
   
  
  
      18.53   18.52
      19.31   19.31
   
     -13324.84640998 
     -13324.84242725 
     -13324.84508240 
   
  
  
      15.39   15.39
      16.17   16.17
   
       -112.49585757 
       -112.50350872 
       -112.49840795