vasp 
  6.2.1  
  16May21 (build Apr 11 2022 11:03:26) complex                          parallel 
  Lin64 
  2024 09 02 
  13:05:12 
 
 
  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 
    
   
   
           0.92906382       0.52820157       0.10792096 
           0.85230063       0.23320272       0.42839103 
           0.13568985       0.44834007       0.19587103 
           0.09523115       0.28331085       0.33366607 
           0.81858062       0.33341092       0.02641803 
           0.95725882       0.42171859       0.51832747 
           0.08228155       0.33371230       0.13717176 
           0.19883882       0.40674970       0.39022121 
           0.83205785       0.54538126       0.52012871 
           0.77214647       0.24420541       0.88268142 
           0.06070963       0.51104144       0.65265607 
           0.01578081       0.20566849       0.76272755 
           0.90245306       0.31057450       0.59336747 
           0.86435669       0.44422876       0.95473554 
           0.13901068       0.32355403       0.73681023 
           0.09859847       0.43486323       0.81871442 
           0.42114435       0.46228329       0.12145801 
           0.36594270       0.29061074       0.42153180 
           0.68922367       0.48293456       0.20810589 
           0.64464812       0.31317984       0.34159232 
           0.32666440       0.31843850       0.01073520 
           0.43510883       0.43734865       0.52089117 
           0.56344885       0.34787749       0.14242574 
           0.69312862       0.42916718       0.40076574 
           0.31651774       0.55469466       0.54908109 
           0.27582187       0.23209003       0.86614338 
           0.59882427       0.51693103       0.65350813 
           0.53839976       0.20958427       0.75187516 
           0.39789786       0.32788547       0.62395334 
           0.36855855       0.42736286       0.91973292 
           0.67061030       0.32666241       0.72816438 
           0.63084366       0.43716937       0.81421459 
           0.64969875       0.69712941       0.62573078 
           0.66144325       0.70945792       0.56049453 
           0.45317583       0.57970059       0.67167909 
   
  
  
           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 
   
  
  
          0.92906382       0.52820157       0.10792096 
          0.85230063       0.23320272       0.42839103 
          0.13568985       0.44834007       0.19587103 
          0.09523115       0.28331085       0.33366607 
          0.81858062       0.33341092       0.02641803 
          0.95725882       0.42171859       0.51832747 
          0.08228155       0.33371230       0.13717176 
          0.19883882       0.40674970       0.39022121 
          0.83205785       0.54538126       0.52012871 
          0.77214647       0.24420541       0.88268142 
          0.06070963       0.51104144       0.65265607 
          0.01578081       0.20566849       0.76272755 
          0.90245306       0.31057450       0.59336747 
          0.86435669       0.44422876       0.95473554 
          0.13901068       0.32355403       0.73681023 
          0.09859847       0.43486323       0.81871442 
          0.42114435       0.46228329       0.12145801 
          0.36594270       0.29061074       0.42153180 
          0.68922367       0.48293456       0.20810589 
          0.64464812       0.31317984       0.34159232 
          0.32666440       0.31843850       0.01073520 
          0.43510883       0.43734865       0.52089117 
          0.56344885       0.34787749       0.14242574 
          0.69312862       0.42916718       0.40076574 
          0.31651774       0.55469466       0.54908109 
          0.27582187       0.23209003       0.86614338 
          0.59882427       0.51693103       0.65350813 
          0.53839976       0.20958427       0.75187516 
          0.39789786       0.32788547       0.62395334 
          0.36855855       0.42736286       0.91973292 
          0.67061030       0.32666241       0.72816438 
          0.63084366       0.43716937       0.81421459 
          0.64969875       0.69712941       0.62573078 
          0.66144325       0.70945792       0.56049453 
          0.45317583       0.57970059       0.67167909 
  
 
 
  
      12.46   12.47
      14.16   14.17
   
         24.76344702 
       9007.15479399 
     -12288.81252117 
       -264.14887334 
       3167.08814863 
      -2605.71786812 
         -0.00818545 
       -196.82373260 
       3755.32434067 
        598.81954964 
        598.82773509 
        598.82227812 
   
  
  
      15.58   15.61
      15.58   15.61
   
        -89.04671269 
        -89.04421194 
        -89.04587910 
   
  
  
      14.90   14.93
      14.91   14.93
   
       -162.56308961 
       -162.53908064 
       -162.55508662 
   
  
  
      15.35   15.38
      15.35   15.38
   
       -165.58447687 
       -165.55872803 
       -165.57589392 
   
  
  
      16.14   16.19
      16.55   16.61
   
       -165.73395337 
       -165.70814708 
       -165.72535127 
   
  
  
      15.33   15.38
      17.14   17.20
   
      -9899.51824218 
      -9899.52862155 
      -9899.52170197 
   
  
  
      13.57   13.61
      14.45   14.49
   
       -120.75966814 
       -120.75977929 
       -120.75970519 
   
  
  
      15.03   15.07
      15.92   15.95
   
       -140.00563503 
       -139.97783485 
       -139.99636831 
   
  
  
      14.45   14.48
      15.35   15.38
   
       -141.99856977 
       -141.96411174 
       -141.98708376