vasp 
  6.2.1  
  16May21 (build Apr 11 2022 11:03:26) complex                          parallel 
  Lin64 
  2024 09 02 
  14:15:23 
 
 
  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 
    
   
   
           0.50606341       0.29373494       0.10604758 
           0.18325397       0.42302926       0.86780107 
           0.82292142       0.16916407       0.27662797 
           0.19935768       0.72229439       0.74442123 
           0.28063169       0.11396012       0.30629031 
           0.83909855       0.90316196       0.18020270 
           0.57349648       0.03451482       0.30017224 
           0.03455006       0.96933513       0.04936522 
           0.22835266       0.16261003       0.91152024 
           0.14016858       0.67701357       0.13532686 
           0.72295807       0.46110374       0.19281789 
           0.83945048       0.68776854       0.79662656 
           0.44506460       0.33612393       0.94050025 
           0.56959525       0.18944223       0.69217481 
           0.06019276       0.79971269       0.23065798 
           0.78329232       0.84778920       0.31283091 
           0.82658721       0.99546783       0.13514843 
           0.91547618       0.04866140       0.12871164 
           0.93766444       0.65214570       0.51677958 
           0.61184868       0.25983161       0.05642168 
           0.70560468       0.53385021       0.32727673 
           0.96823906       0.81786936       0.63984541 
           0.02343772       0.67453959       0.50627806 
           0.33081290       0.86887875       0.52299170 
           0.18680782       0.90849532       0.62218544 
           0.38676834       0.53733533       0.06594676 
           0.80254593       0.74256444       0.63584326 
           0.11919223       0.15068127       0.31981173 
           0.01352338       0.66276565       0.47403477 
           0.73603296       0.92259193       0.21428300 
           0.03303284       0.46062032       0.36691517 
           0.33247794       0.12592243       0.84485692 
           0.22727603       0.90343913       0.73698362 
           0.48226105       0.03798964       0.00469883 
           0.33134674       0.62403253       0.11879541 
   
  
  
           1 
           2 
           3 
           4 
           5 
           6 
           7 
           8 
           9 
          10 
          11 
          12 
          13 
          14 
          15 
          16 
          17 
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          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
       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 
   
  
  
          0.50606341       0.29373494       0.10604758 
          0.18325397       0.42302926       0.86780107 
          0.82292142       0.16916407       0.27662797 
          0.19935768       0.72229439       0.74442123 
          0.28063169       0.11396012       0.30629031 
          0.83909855       0.90316196       0.18020270 
          0.57349648       0.03451482       0.30017224 
          0.03455006       0.96933513       0.04936522 
          0.22835266       0.16261003       0.91152024 
          0.14016858       0.67701357       0.13532686 
          0.72295807       0.46110374       0.19281789 
          0.83945048       0.68776854       0.79662656 
          0.44506460       0.33612393       0.94050025 
          0.56959525       0.18944223       0.69217481 
          0.06019276       0.79971269       0.23065798 
          0.78329232       0.84778920       0.31283091 
          0.82658721       0.99546783       0.13514843 
          0.91547618       0.04866140       0.12871164 
          0.93766444       0.65214570       0.51677958 
          0.61184868       0.25983161       0.05642168 
          0.70560468       0.53385021       0.32727673 
          0.96823906       0.81786936       0.63984541 
          0.02343772       0.67453959       0.50627806 
          0.33081290       0.86887875       0.52299170 
          0.18680782       0.90849532       0.62218544 
          0.38676834       0.53733533       0.06594676 
          0.80254593       0.74256444       0.63584326 
          0.11919223       0.15068127       0.31981173 
          0.01352338       0.66276565       0.47403477 
          0.73603296       0.92259193       0.21428300 
          0.03303284       0.46062032       0.36691517 
          0.33247794       0.12592243       0.84485692 
          0.22727603       0.90343913       0.73698362 
          0.48226105       0.03798964       0.00469883 
          0.33134674       0.62403253       0.11879541 
  
 
 
  
       6.04    6.12
       6.58    6.66
   
         24.76344702 
        210.09535229 
      -2612.41086341 
       -288.82245244 
       3170.77583059 
      -2609.60722799 
         -0.00546243 
       -225.24470062 
       3755.32434067 
       1424.86826369 
       1424.87372612 
       1424.87008450 
   
  
  
       7.81    7.88
       7.81    7.88
   
        671.11228179 
        671.11006733 
        671.11154364 
   
  
  
       9.79    9.85
       9.79    9.85
   
        447.56754740 
        447.57765565 
        447.57091681 
   
  
  
       8.27    8.32
       8.27    8.32
   
        418.19534640 
        418.15404250 
        418.18157843 
   
  
  
       8.56    8.61
       8.68    8.73
   
        416.29430243 
        416.23649443 
        416.27503310 
   
  
  
       8.37    8.43
       8.94    9.01
   
        501.19377418 
        501.18948990 
        501.19234609 
   
  
  
       8.25    8.33
       8.82    8.90
   
        512.85231200 
        512.90657687 
        512.87040029 
   
  
  
       7.07    7.13
       7.64    7.71
   
        533.78160150 
        533.77135049 
        533.77818450 
   
  
  
       8.25    8.30
       8.82    8.87
   
        534.78389747 
        534.81426704 
        534.79402066 
   
  
  
       7.14    7.20
       7.70    7.77
   
        544.64543662 
        544.66414162 
        544.65167162 
   
  
  
       6.76    6.83
       7.33    7.40
   
        542.03557097 
        542.03717723 
        542.03610639 
   
  
  
       7.30    7.35
       7.88    7.94
   
        539.86852942 
        539.88818808 
        539.87508230 
   
  
  
       7.77    7.83
       8.34    8.40
   
        550.40093995 
        550.39933313 
        550.40040434 
   
  
  
       6.97    7.02
       7.53    7.59
   
        550.14331800 
        550.13608849 
        550.14090816 
   
  
  
       7.81    7.86
       8.37    8.43
   
        550.53929002 
        550.51898971 
        550.53252325 
   
  
  
       6.95    7.02
       7.52    7.60
   
        550.24124533 
        550.21483972 
        550.23244346 
   
  
  
       7.55    7.61
       8.13    8.20
   
        546.80669503 
        546.76209195 
        546.79182734