vasp 
  6.2.1  
  16May21 (build Apr 11 2022 11:03:26) complex                          parallel 
  Lin64 
  2024 09 02 
  18:03:47 
 
 
  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 
    
   
   
           0.93024508       0.52907695       0.10907064 
           0.85278467       0.23309728       0.42801424 
           0.13635850       0.44862044       0.19529298 
           0.09619371       0.28246405       0.33252411 
           0.81786759       0.33465520       0.02611892 
           0.95800203       0.42186163       0.51807857 
           0.08184581       0.33394505       0.13673604 
           0.19894996       0.40717299       0.38961105 
           0.83061811       0.54494775       0.51805636 
           0.77193712       0.24491264       0.88361273 
           0.05947669       0.51171028       0.65200890 
           0.01491402       0.20581528       0.76392925 
           0.90296433       0.31074146       0.59258652 
           0.86556669       0.44550494       0.95535456 
           0.13811135       0.32387283       0.73690050 
           0.09837929       0.43558979       0.81802298 
           0.42243546       0.46162541       0.12157525 
           0.36568141       0.29270330       0.42114686 
           0.68918997       0.48483381       0.20889134 
           0.64520136       0.31273778       0.34018646 
           0.32634212       0.31886541       0.00988779 
           0.43563217       0.43714679       0.52080199 
           0.56241860       0.34755475       0.14180570 
           0.69365474       0.42966041       0.40005588 
           0.31780656       0.55416939       0.55115567 
           0.27585199       0.23246426       0.86575576 
           0.60092412       0.51625493       0.65407228 
           0.53891129       0.21047720       0.75135794 
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           0.67282780       0.32712095       0.72849590 
           0.63285686       0.43724009       0.81487679 
           0.64427008       0.69288123       0.62527108 
           0.65501276       0.70447617       0.56233148 
           0.45449085       0.57910400       0.67413153 
   
  
  
           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
         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 
   
  
  
          0.93024508       0.52907695       0.10907064 
          0.85278467       0.23309728       0.42801424 
          0.13635850       0.44862044       0.19529298 
          0.09619371       0.28246405       0.33252411 
          0.81786759       0.33465520       0.02611892 
          0.95800203       0.42186163       0.51807857 
          0.08184581       0.33394505       0.13673604 
          0.19894996       0.40717299       0.38961105 
          0.83061811       0.54494775       0.51805636 
          0.77193712       0.24491264       0.88361273 
          0.05947669       0.51171028       0.65200890 
          0.01491402       0.20581528       0.76392925 
          0.90296433       0.31074146       0.59258652 
          0.86556669       0.44550494       0.95535456 
          0.13811135       0.32387283       0.73690050 
          0.09837929       0.43558979       0.81802298 
          0.42243546       0.46162541       0.12157525 
          0.36568141       0.29270330       0.42114686 
          0.68918997       0.48483381       0.20889134 
          0.64520136       0.31273778       0.34018646 
          0.32634212       0.31886541       0.00988779 
          0.43563217       0.43714679       0.52080199 
          0.56241860       0.34755475       0.14180570 
          0.69365474       0.42966041       0.40005588 
          0.31780656       0.55416939       0.55115567 
          0.27585199       0.23246426       0.86575576 
          0.60092412       0.51625493       0.65407228 
          0.53891129       0.21047720       0.75135794 
          0.39863936       0.32740136       0.62516871 
          0.36909791       0.42796633       0.91900543 
          0.67282780       0.32712095       0.72849590 
          0.63285686       0.43724009       0.81487679 
          0.64427008       0.69288123       0.62527108 
          0.65501276       0.70447617       0.56233148 
          0.45449085       0.57910400       0.67413153 
  
 
 
  
      11.44   11.47
      12.60   12.62
   
         24.76344702 
       9028.18470698 
     -12309.51272022 
       -264.10874812 
       3167.08814863 
      -2605.71786812 
         -0.01016002 
       -196.86332458 
       3755.32434067 
        599.14782224 
        599.15798226 
        599.15120892 
   
  
  
      15.61   15.63
      15.61   15.63
   
        -88.90831203 
        -88.90405069 
        -88.90689158 
   
  
  
      14.74   14.77
      14.74   14.77
   
       -162.25907702 
       -162.23397262 
       -162.25070888 
   
  
  
      15.20   15.24
      15.20   15.24
   
       -165.29428131 
       -165.26778164 
       -165.28544809 
   
  
  
      16.34   16.40
      16.51   16.57
   
       -165.44846075 
       -165.42191794 
       -165.43961315 
   
  
  
      13.32   13.37
      14.13   14.18
   
       -459.57329033 
       -459.57544456 
       -459.57400841 
   
  
  
      14.80   14.85
      15.68   15.73
   
      -1623.77048956 
      -1623.76964707 
      -1623.77020873 
   
  
  
      15.75   15.78
      16.58   16.63
   
       -140.05856433 
       -140.04677302 
       -140.05463390 
   
  
  
      13.37   13.43
      14.20   14.26
   
       -139.06979767 
       -139.04731607 
       -139.06230380 
   
  
  
      14.27   14.32
      15.11   15.15
   
       -141.70605781 
       -141.68122858 
       -141.69778140 
   
  
  
      13.34   13.40
      14.18   14.24
   
       -141.42966626 
       -141.43476125 
       -141.43136459 
   
  
  
      13.32   13.37
      14.24   14.28
   
       -146.76870494 
       -146.74994210 
       -146.76245066 
   
  
  
      13.65   13.70
      14.54   14.58
   
       -154.79270121 
       -154.80092291 
       -154.79544178 
   
  
  
      13.52   13.59
      14.33   14.39
   
       -161.29550207 
       -161.29220574 
       -161.29440329 
   
  
  
      13.12   13.15
      13.95   13.98
   
       -168.71483592 
       -168.74065313 
       -168.72344166 
   
  
  
      13.78   13.82
      14.59   14.64
   
       -172.16729218 
       -172.19150746 
       -172.17536394 
   
  
  
      14.27   14.31
      15.11   15.16
   
       -173.18880255 
       -173.21428102 
       -173.19729537 
   
  
  
      13.77   13.81
      14.65   14.69
   
       -173.82847680 
       -173.85417756 
       -173.83704372 
   
  
  
      14.41   14.46
      15.22   15.27
   
       -173.98090472 
       -174.00603672 
       -173.98928205 
   
  
  
      13.87   13.91
      14.72   14.75
   
       -174.12283351 
       -174.14767246 
       -174.13111316