vasp 
  6.2.1  
  16May21 (build Apr 11 2022 11:03:26) complex                          parallel 
  Lin64 
  2024 09 01 
  04:12:30 
 
 
  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 
    
   
   
           0.93088861       0.52931444       0.10947565 
           0.85099548       0.23357634       0.42664511 
           0.13727441       0.44872668       0.19588817 
           0.09490466       0.28285194       0.33226309 
           0.81780768       0.33448509       0.02623826 
           0.95609203       0.42207754       0.51653834 
           0.08184863       0.33424426       0.13667364 
           0.20026392       0.40777665       0.39046710 
           0.82876050       0.54678040       0.52113550 
           0.77171250       0.24509318       0.88290289 
           0.05841902       0.51123082       0.65136444 
           0.01332840       0.20617341       0.76169757 
           0.90287378       0.31085830       0.59170109 
           0.86527750       0.44551718       0.95632971 
           0.13742842       0.32442790       0.73633619 
           0.09732181       0.43593581       0.81833142 
           0.42313493       0.46126609       0.12107713 
           0.36435988       0.29315087       0.42131144 
           0.68910233       0.48536403       0.20912336 
           0.64316203       0.31330072       0.33969441 
           0.32522684       0.31869489       0.00891298 
           0.43617597       0.43818803       0.52268058 
           0.56143226       0.34725932       0.14085037 
           0.69198228       0.42996925       0.40004617 
           0.31752773       0.55458333       0.55227182 
           0.27407898       0.23265538       0.86388076 
           0.59984845       0.51782680       0.65739831 
           0.53835326       0.21096967       0.75080873 
           0.39825273       0.32816150       0.62505514 
           0.36845414       0.42784117       0.91859182 
           0.67303891       0.32736512       0.72777267 
           0.63268437       0.43728938       0.81562508 
           0.66149904       0.68588399       0.62529070 
           0.66054689       0.70007660       0.56184764 
           0.45140194       0.57975609       0.67566491 
   
  
  
           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
      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 
   
  
  
          0.93088861       0.52931444       0.10947565 
          0.85099548       0.23357634       0.42664511 
          0.13727441       0.44872668       0.19588817 
          0.09490466       0.28285194       0.33226309 
          0.81780768       0.33448509       0.02623826 
          0.95609203       0.42207754       0.51653834 
          0.08184863       0.33424426       0.13667364 
          0.20026392       0.40777665       0.39046710 
          0.82876050       0.54678040       0.52113550 
          0.77171250       0.24509318       0.88290289 
          0.05841902       0.51123082       0.65136444 
          0.01332840       0.20617341       0.76169757 
          0.90287378       0.31085830       0.59170109 
          0.86527750       0.44551718       0.95632971 
          0.13742842       0.32442790       0.73633619 
          0.09732181       0.43593581       0.81833142 
          0.42313493       0.46126609       0.12107713 
          0.36435988       0.29315087       0.42131144 
          0.68910233       0.48536403       0.20912336 
          0.64316203       0.31330072       0.33969441 
          0.32522684       0.31869489       0.00891298 
          0.43617597       0.43818803       0.52268058 
          0.56143226       0.34725932       0.14085037 
          0.69198228       0.42996925       0.40004617 
          0.31752773       0.55458333       0.55227182 
          0.27407898       0.23265538       0.86388076 
          0.59984845       0.51782680       0.65739831 
          0.53835326       0.21096967       0.75080873 
          0.39825273       0.32816150       0.62505514 
          0.36845414       0.42784117       0.91859182 
          0.67303891       0.32736512       0.72777267 
          0.63268437       0.43728938       0.81562508 
          0.66149904       0.68588399       0.62529070 
          0.66054689       0.70007660       0.56184764 
          0.45140194       0.57975609       0.67566491 
  
 
 
  
      12.46   12.48
      13.35   13.36
   
         24.76344702 
       9034.16712054 
     -12315.43570553 
       -264.09219194 
       3167.08814863 
      -2605.71786812 
         -0.00964909 
       -196.83956078 
       3755.32434067 
        599.24808142 
        599.25773051 
        599.25129778 
   
  
  
      15.61   15.62
      15.61   15.62
   
        -89.08333145 
        -89.07291498 
        -89.07985930 
   
  
  
      14.92   14.97
      14.92   14.97
   
       -162.47538522 
       -162.44860028 
       -162.46645691 
   
  
  
      15.24   15.28
      15.24   15.28
   
       -165.47359103 
       -165.44510316 
       -165.46409507 
   
  
  
      15.94   15.98
      16.11   16.15
   
       -165.62132493 
       -165.59281962 
       -165.61182316 
   
  
  
      15.80   15.83
      16.80   16.83
   
      -6092.44899999 
      -6092.45937990 
      -6092.45245996 
   
  
  
      15.30   15.33
      16.20   16.22
   
     -31189.79246555 
     -31189.76488223 
     -31189.78327111 
   
  
  
      14.02   14.05
      14.92   14.94
   
       -129.14154616 
       -129.11063864 
       -129.13124365 
   
  
  
      14.52   14.55
      15.41   15.44
   
       -137.31437348 
       -137.28399177 
       -137.30424624 
   
  
  
      17.80   17.82
      18.69   18.71
   
     -17628.34731321 
     -17628.33444314 
     -17628.34302318 
   
  
  
      13.66   13.70
      14.55   14.58
   
       -120.11297894 
       -120.08848742 
       -120.10481510 
   
  
  
      14.90   14.94
      15.82   15.86
   
       -139.75976149 
       -139.76131580 
       -139.76027959 
   
  
  
      14.30   14.32
      15.30   15.32
   
       -147.39786748 
       -147.39155721 
       -147.39576406 
   
  
  
      14.33   14.35
      15.56   15.59
   
       -154.49698854 
       -154.50703131 
       -154.50033613 
   
  
  
      11.73   11.77
      13.11   13.14
   
       -157.42500442 
       -157.42376577 
       -157.42459153 
   
  
  
      16.43   16.46
      17.35   17.38
   
       -163.40015309 
       -163.39932007 
       -163.39987542