vasp 
  6.2.1  
  16May21 (build Apr 11 2022 11:03:26) complex                          parallel 
  Lin64 
  2024 09 01 
  22:41:04 
 
 
  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 
    
   
   
           0.91366675       0.52971217       0.10532364 
           0.86113008       0.23586415       0.42239700 
           0.12693965       0.45165983       0.19324242 
           0.11401129       0.29099737       0.34114353 
           0.82455118       0.33449196       0.02104523 
           0.95696287       0.42717300       0.52650327 
           0.08681716       0.33453199       0.13762504 
           0.19171632       0.40702937       0.38543630 
           0.83898617       0.54350797       0.48097895 
           0.77559744       0.24697699       0.87593117 
           0.01577509       0.51978224       0.66815616 
           0.02712508       0.20784550       0.76732853 
           0.90124868       0.31092146       0.59422286 
           0.84448962       0.44672074       0.94391312 
           0.14641760       0.32502240       0.73326327 
           0.09874073       0.43770897       0.82063799 
           0.40098320       0.47920443       0.11952202 
           0.39331200       0.27445991       0.42150865 
           0.68206447       0.47552030       0.19587015 
           0.65684498       0.31999233       0.35617684 
           0.33857252       0.32772241       0.01597052 
           0.43229193       0.42437686       0.50916899 
           0.57804997       0.35031251       0.14945303 
           0.68994672       0.43020828       0.40078821 
           0.24832181       0.51057250       0.52240550 
           0.28663208       0.23655120       0.87362600 
           0.67139433       0.57711719       0.67590339 
           0.53830796       0.21423191       0.75311389 
           0.40689287       0.31846547       0.61910887 
           0.38236715       0.43814588       0.91281218 
           0.67060795       0.34215937       0.73261199 
           0.63244868       0.47713935       0.78340097 
           0.71959467       0.60675725       0.78090563 
           0.61742328       0.68776855       0.49888302 
           0.38522781       0.56802031       0.65351387 
   
  
  
           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 
          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
      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
         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
    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 
   
  
  
          0.91366675       0.52971217       0.10532364 
          0.86113008       0.23586415       0.42239700 
          0.12693965       0.45165983       0.19324242 
          0.11401129       0.29099737       0.34114353 
          0.82455118       0.33449196       0.02104523 
          0.95696287       0.42717300       0.52650327 
          0.08681716       0.33453199       0.13762504 
          0.19171632       0.40702937       0.38543630 
          0.83898617       0.54350797       0.48097895 
          0.77559744       0.24697699       0.87593117 
          0.01577509       0.51978224       0.66815616 
          0.02712508       0.20784550       0.76732853 
          0.90124868       0.31092146       0.59422286 
          0.84448962       0.44672074       0.94391312 
          0.14641760       0.32502240       0.73326327 
          0.09874073       0.43770897       0.82063799 
          0.40098320       0.47920443       0.11952202 
          0.39331200       0.27445991       0.42150865 
          0.68206447       0.47552030       0.19587015 
          0.65684498       0.31999233       0.35617684 
          0.33857252       0.32772241       0.01597052 
          0.43229193       0.42437686       0.50916899 
          0.57804997       0.35031251       0.14945303 
          0.68994672       0.43020828       0.40078821 
          0.24832181       0.51057250       0.52240550 
          0.28663208       0.23655120       0.87362600 
          0.67139433       0.57711719       0.67590339 
          0.53830796       0.21423191       0.75311389 
          0.40689287       0.31846547       0.61910887 
          0.38236715       0.43814588       0.91281218 
          0.67060795       0.34215937       0.73261199 
          0.63244868       0.47713935       0.78340097 
          0.71959467       0.60675725       0.78090563 
          0.61742328       0.68776855       0.49888302 
          0.38522781       0.56802031       0.65351387 
  
 
 
  
      12.34   12.36
      14.01   14.03
   
         24.76344702 
       8974.08387967 
     -12281.79295553 
       -266.04971178 
       3167.08814863 
      -2605.71786812 
          0.00961325 
       -185.11326986 
       3755.32434067 
        582.59562397 
        582.58601072 
        582.59241955 
   
  
  
      16.02   16.05
      16.03   16.05
   
        -88.77106029 
        -88.75354989 
        -88.76522349 
   
  
  
      14.59   14.66
      14.59   14.66
   
       -160.12164947 
       -160.09457366 
       -160.11262420 
   
  
  
      15.80   15.85
      15.80   15.85
   
       -163.18398725 
       -163.15678372 
       -163.17491941 
   
  
  
      16.03   16.10
      16.22   16.29
   
       -163.31935704 
       -163.29211940 
       -163.31027783 
   
  
  
      13.90   13.94
      15.38   15.43
   
       -142.02103635 
       -142.04292948 
       -142.02833406 
   
  
  
      15.04   15.09
      16.04   16.09
   
       -142.68000207 
       -142.64743736 
       -142.66914717 
   
  
  
      13.40   13.47
      14.24   14.31
   
       -138.99060942 
       -138.98114583 
       -138.98745489 
   
  
  
      14.24   14.28
      15.16   15.20
   
       -140.98084119 
       -140.96971988 
       -140.97713409 
   
  
  
      14.40   14.45
      15.35   15.40
   
       -145.05158114 
       -145.04928455 
       -145.05081561 
   
  
  
      12.80   12.85
      13.69   13.74
   
       -152.34728045 
       -152.35994654 
       -152.35150248 
   
  
  
      13.25   13.33
      14.04   14.12
   
       -159.58135862 
       -159.60500906 
       -159.58924210 
   
  
  
      13.92   13.96
      14.83   14.87
   
       -162.62580158 
       -162.64493351 
       -162.63217889 
   
  
  
      13.41   13.45
      14.43   14.47
   
       -164.67894751 
       -164.68727027 
       -164.68172176 
   
  
  
      14.09   14.16
      14.97   15.04
   
       -165.71573670 
       -165.71517591 
       -165.71554977 
   
  
  
      14.55   14.60
      15.51   15.56
   
       -166.06051998 
       -166.05800493 
       -166.05968163 
   
  
  
      14.50   14.55
      15.63   15.68
   
       -166.25083357 
       -166.24734643 
       -166.24967119 
   
  
  
      14.23   14.29
      15.35   15.41
   
       -166.38493119 
       -166.38170460 
       -166.38385566 
   
  
  
      14.15   14.20
      15.00   15.05
   
       -166.46530421 
       -166.46228656 
       -166.46429832