vasp 
  6.2.1  
  16May21 (build Apr 11 2022 11:03:26) complex                          parallel 
  Lin64 
  2024 08 31 
  06:24:12 
 
 
  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 
    
   
   
           0.92325689       0.52778482       0.10603935 
           0.85692955       0.23492268       0.42940533 
           0.13437930       0.45028217       0.19691419 
           0.09929890       0.28675733       0.33710052 
           0.82164530       0.33283578       0.02692012 
           0.95816496       0.42245353       0.51866100 
           0.08502190       0.33481212       0.13873212 
           0.19909736       0.40651656       0.38941651 
           0.83328575       0.54692634       0.52191116 
           0.77478074       0.24456087       0.88152914 
           0.06078919       0.51084880       0.65345392 
           0.02123578       0.20691704       0.76336148 
           0.90332480       0.31173591       0.59582423 
           0.86413092       0.44338373       0.95299722 
           0.14351759       0.32442576       0.73656466 
           0.10038536       0.43533168       0.81885450 
           0.41506112       0.47031626       0.12067248 
           0.37272971       0.28253860       0.42341310 
           0.68793667       0.47757172       0.20404245 
           0.64583265       0.31301337       0.34397517 
           0.33219145       0.32160960       0.01439686 
           0.43492927       0.43650840       0.51989427 
           0.57002317       0.35164502       0.14628454 
           0.69425377       0.43103874       0.40259436 
           0.30807741       0.55048277       0.54114520 
           0.27904220       0.23441726       0.86956778 
           0.59592484       0.51914885       0.65158710 
           0.53927010       0.20977795       0.75481536 
           0.40022539       0.32708654       0.62105030 
           0.36907612       0.42991247       0.92151598 
           0.66915728       0.32779892       0.72866004 
           0.62894921       0.43881454       0.81328102 
           0.64768161       0.68814622       0.62872232 
           0.63759395       0.69573627       0.56185674 
           0.44826010       0.58261350       0.65673165 
   
  
  
           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 
   
  
  
          0.92325689       0.52778482       0.10603935 
          0.85692955       0.23492268       0.42940533 
          0.13437930       0.45028217       0.19691419 
          0.09929890       0.28675733       0.33710052 
          0.82164530       0.33283578       0.02692012 
          0.95816496       0.42245353       0.51866100 
          0.08502190       0.33481212       0.13873212 
          0.19909736       0.40651656       0.38941651 
          0.83328575       0.54692634       0.52191116 
          0.77478074       0.24456087       0.88152914 
          0.06078919       0.51084880       0.65345392 
          0.02123578       0.20691704       0.76336148 
          0.90332480       0.31173591       0.59582423 
          0.86413092       0.44338373       0.95299722 
          0.14351759       0.32442576       0.73656466 
          0.10038536       0.43533168       0.81885450 
          0.41506112       0.47031626       0.12067248 
          0.37272971       0.28253860       0.42341310 
          0.68793667       0.47757172       0.20404245 
          0.64583265       0.31301337       0.34397517 
          0.33219145       0.32160960       0.01439686 
          0.43492927       0.43650840       0.51989427 
          0.57002317       0.35164502       0.14628454 
          0.69425377       0.43103874       0.40259436 
          0.30807741       0.55048277       0.54114520 
          0.27904220       0.23441726       0.86956778 
          0.59592484       0.51914885       0.65158710 
          0.53927010       0.20977795       0.75481536 
          0.40022539       0.32708654       0.62105030 
          0.36907612       0.42991247       0.92151598 
          0.66915728       0.32779892       0.72866004 
          0.62894921       0.43881454       0.81328102 
          0.64768161       0.68814622       0.62872232 
          0.63759395       0.69573627       0.56185674 
          0.44826010       0.58261350       0.65673165 
  
 
 
  
      12.44   12.45
      13.20   13.22
   
         24.76344702 
       9033.15528500 
     -12315.00472786 
       -264.10602411 
       3167.08814863 
      -2605.71786812 
         -0.00784257 
       -196.36765818 
       3755.32434067 
        599.12710049 
        599.13494305 
        599.12971467 
   
  
  
      15.59   15.61
      15.59   15.61
   
        -88.81615462 
        -88.81291125 
        -88.81507350 
   
  
  
      14.74   14.76
      14.75   14.76
   
       -162.34200831 
       -162.32392753 
       -162.33598138 
   
  
  
      15.32   15.34
      15.32   15.34
   
       -165.40325419 
       -165.38400586 
       -165.39683808 
   
  
  
      15.79   15.84
      16.04   16.11
   
       -165.55602791 
       -165.53673655 
       -165.54959746 
   
  
  
      16.40   16.46
      17.65   17.70
   
     -16182.48264262 
     -16182.47967104 
     -16182.48165209 
   
  
  
      12.85   12.89
      13.74   13.78
   
       -103.93798516 
       -103.94463527 
       -103.94020187 
   
  
  
      16.07   16.12
      17.10   17.15
   
       -138.93701575 
       -138.94854745 
       -138.94085965