vasp 
  6.2.1  
  16May21 (build Apr 11 2022 11:03:26) complex                          parallel 
  Lin64 
  2024 09 02 
  15:21:38 
 
 
  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 
    
   
   
           0.92925819       0.52857850       0.10833609 
           0.85266080       0.23317576       0.42825435 
           0.13583156       0.44850531       0.19557229 
           0.09576346       0.28306046       0.33321755 
           0.81837628       0.33395020       0.02628322 
           0.95746205       0.42179520       0.51808156 
           0.08215234       0.33386555       0.13694516 
           0.19885166       0.40680663       0.38988092 
           0.83133495       0.54522902       0.51946446 
           0.77208370       0.24450335       0.88298069 
           0.05979908       0.51121647       0.65247516 
           0.01556254       0.20576358       0.76323990 
           0.90275970       0.31068545       0.59311351 
           0.86493178       0.44471999       0.95493364 
           0.13870784       0.32375536       0.73685510 
           0.09857195       0.43523543       0.81833115 
           0.42176750       0.46215479       0.12152606 
           0.36595774       0.29131378       0.42142848 
           0.68907936       0.48357617       0.20836653 
           0.64496455       0.31300722       0.34099855 
           0.32670906       0.31876759       0.01041977 
           0.43515561       0.43722317       0.52093698 
           0.56299750       0.34790476       0.14222079 
           0.69334990       0.42945101       0.40053299 
           0.31837937       0.55434077       0.55076540 
           0.27583151       0.23234073       0.86601614 
           0.59964252       0.51683343       0.65403843 
           0.53867878       0.20999965       0.75178533 
           0.39823705       0.32773408       0.62442634 
           0.36865062       0.42766875       0.91934388 
           0.67152506       0.32691770       0.72829329 
           0.63177200       0.43714701       0.81438441 
           0.64788786       0.69484683       0.62612756 
           0.65837809       0.70704000       0.56081864 
           0.45238835       0.57955845       0.67149789 
   
  
  
           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 
   
  
  
          0.92925819       0.52857850       0.10833609 
          0.85266080       0.23317576       0.42825435 
          0.13583156       0.44850531       0.19557229 
          0.09576346       0.28306046       0.33321755 
          0.81837628       0.33395020       0.02628322 
          0.95746205       0.42179520       0.51808156 
          0.08215234       0.33386555       0.13694516 
          0.19885166       0.40680663       0.38988092 
          0.83133495       0.54522902       0.51946446 
          0.77208370       0.24450335       0.88298069 
          0.05979908       0.51121647       0.65247516 
          0.01556254       0.20576358       0.76323990 
          0.90275970       0.31068545       0.59311351 
          0.86493178       0.44471999       0.95493364 
          0.13870784       0.32375536       0.73685510 
          0.09857195       0.43523543       0.81833115 
          0.42176750       0.46215479       0.12152606 
          0.36595774       0.29131378       0.42142848 
          0.68907936       0.48357617       0.20836653 
          0.64496455       0.31300722       0.34099855 
          0.32670906       0.31876759       0.01041977 
          0.43515561       0.43722317       0.52093698 
          0.56299750       0.34790476       0.14222079 
          0.69334990       0.42945101       0.40053299 
          0.31837937       0.55434077       0.55076540 
          0.27583151       0.23234073       0.86601614 
          0.59964252       0.51683343       0.65403843 
          0.53867878       0.20999965       0.75178533 
          0.39823705       0.32773408       0.62442634 
          0.36865062       0.42766875       0.91934388 
          0.67152506       0.32691770       0.72829329 
          0.63177200       0.43714701       0.81438441 
          0.64788786       0.69484683       0.62612756 
          0.65837809       0.70704000       0.56081864 
          0.45238835       0.57955845       0.67149789 
  
 
 
  
      12.34   12.35
      14.53   14.54
   
         24.76344702 
       9021.30023516 
     -12302.13848907 
       -264.08941214 
       3167.08814863 
      -2605.71786812 
         -0.01000881 
       -197.10009471 
       3755.32434067 
        599.42029863 
        599.43030744 
        599.42363490 
   
  
  
      15.66   15.68
      15.66   15.68
   
        -88.96906301 
        -88.96494140 
        -88.96768914 
   
  
  
      14.78   14.81
      14.78   14.81
   
       -162.52999928 
       -162.50453672 
       -162.52151176 
   
  
  
      15.32   15.35
      15.32   15.36
   
       -165.56770292 
       -165.54041658 
       -165.55860748 
   
  
  
      16.38   16.42
      16.56   16.59
   
       -165.71728319 
       -165.68994381 
       -165.70817006 
   
  
  
      14.45   14.50
      15.50   15.55
   
     -14574.67513177 
     -14574.66998566 
     -14574.67341640 
   
  
  
      12.64   12.70
      13.87   13.92
   
       -106.04990040 
       -106.04489668 
       -106.04823249 
   
  
  
      15.23   15.27
      16.14   16.18
   
       -137.61297564 
       -137.59910054 
       -137.60835061