vasp 
  6.2.1  
  16May21 (build Apr 11 2022 11:03:26) complex                          parallel 
  Lin64 
  2024 09 04 
  20:47:23 
 
 
  No title
       0
  Normal
  Normal (blocked Davidson)
   F  
       2
       2
       1
     200
       2
      -1
        0.00001000
       -0.02000000
       0
       2
       1
      400.00000000
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  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 
    
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            0.00000000       0.00000000       0.09227425 
    
   
   
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           0.98853879       0.47870723       0.08018280 
           0.07706709       0.32249378       0.17195522 
           0.70730048       0.40324194       0.84218218 
           0.67856560       0.45488530       0.36454437 
           0.96334518       0.36601990       0.98773401 
           0.99752377       0.43174150       0.28137442 
           0.47785895       0.53978147       0.43550118 
           0.67255093       0.29215423       0.72313769 
           0.36816092       0.94977278       0.09121482 
           0.91618179       0.17454360       0.63838264 
           0.77542489       0.36471138       0.52569286 
           0.58617542       0.50897173       0.63304202 
           0.01595693       0.33142599       0.64080417 
           0.98942507       0.53005814       0.63910439 
           0.29553164       0.47008247       0.06438874 
           0.30170029       0.26103618       0.27593719 
           0.64060749       0.44712130       0.05098599 
           0.57150834       0.30324969       0.22609079 
           0.20886489       0.33177505       0.90201364 
           0.35087422       0.38155498       0.18590150 
           0.47117664       0.35514800       0.01413369 
           0.74653347       0.35871159       0.19238278 
           0.30297938       0.15621425       0.07695315 
           0.15591731       0.22287733       0.80466357 
           0.07140035       0.86935942       0.60299908 
           0.41109612       0.21780254       0.65936484 
           0.23719731       0.32580416       0.46752728 
           0.23230773       0.45193896       0.82655296 
           0.48485922       0.40279728       0.62645488 
           0.21245717       0.58934322       0.37840842 
           0.04695406       0.30045951       0.33622794 
           0.22147637       0.76681591       0.03407046 
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           0.85959065       0.54244814       0.17654468 
   
  
  
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          29 
          30 
          31 
          32 
          33 
          34 
          35 
          36 
  
 
 
  
          3        2        2 
         0.00000000       0.00000000       0.00000000 
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          0.08333333 
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          0.08333333 
          0.16666667 
          0.08333333 
          0.16666667 
          0.08333333 
          0.16666667 
  
 
 
  
   No title
    F  
  
  
   normal
       400.00000000
       605.39200000
         0.00001000
       38
       10
      108
       -1
       -1
       142.00000000
        0
        0
        0
        0
         0.00000000
   
         1
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          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
         -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
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           0.30000000
          4
           0.40000000
    
   
   
          0.40000000
          1.00000000
          0.10000000
          1.60000000
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          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
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        2
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         0.50000000
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         0.00010000
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        1
        1
      256
        16.00000000
  
  
        2
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        0
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      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     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
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         1.00000000
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        1
        1
        1
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    F  
    F  
        0
        0
    F  
         0.00000000
         0.00000000
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    F  
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         0.12340000
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        0
        27.21602676
         1.00000000
  
  
    F  
    F  
    F  
    F  
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         0.00000000
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    F  
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    T  
    F  
    F  
    F  
    T  
        0
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    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
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    F  
       -1
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        0
        0
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       -1
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        1
        3
        4
        0
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        0
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    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  
  
 
 
        36 
         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
    O    2
    H    3
    H    3
   
  
  
   type
   atomspertype
   element
   mass
   valence
   pseudopotential
   
      32Si     28.08500000      4.00000000  PAW_PBE Si 05Jan2001                  
       2O      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 
   
  
  
          0.80057253       0.55723738       0.02915358 
          0.88482766       0.21011861       0.36577207 
          0.98853879       0.47870723       0.08018280 
          0.07706709       0.32249378       0.17195522 
          0.70730048       0.40324194       0.84218218 
          0.67856560       0.45488530       0.36454437 
          0.96334518       0.36601990       0.98773401 
          0.99752377       0.43174150       0.28137442 
          0.47785895       0.53978147       0.43550118 
          0.67255093       0.29215423       0.72313769 
          0.36816092       0.94977278       0.09121482 
          0.91618179       0.17454360       0.63838264 
          0.77542489       0.36471138       0.52569286 
          0.58617542       0.50897173       0.63304202 
          0.01595693       0.33142599       0.64080417 
          0.98942507       0.53005814       0.63910439 
          0.29553164       0.47008247       0.06438874 
          0.30170029       0.26103618       0.27593719 
          0.64060749       0.44712130       0.05098599 
          0.57150834       0.30324969       0.22609079 
          0.20886489       0.33177505       0.90201364 
          0.35087422       0.38155498       0.18590150 
          0.47117664       0.35514800       0.01413369 
          0.74653347       0.35871159       0.19238278 
          0.30297938       0.15621425       0.07695315 
          0.15591731       0.22287733       0.80466357 
          0.07140035       0.86935942       0.60299908 
          0.41109612       0.21780254       0.65936484 
          0.23719731       0.32580416       0.46752728 
          0.23230773       0.45193896       0.82655296 
          0.48485922       0.40279728       0.62645488 
          0.21245717       0.58934322       0.37840842 
          0.04695406       0.30045951       0.33622794 
          0.22147637       0.76681591       0.03407046 
          0.46855495       0.14314071       0.20199118 
          0.85959065       0.54244814       0.17654468 
  
 
 
  
      20.62   20.67
      22.39   22.44
   
         27.86983208 
       5142.32086004 
      -8912.93882712 
       -248.66857476 
       3513.49417245 
      -2953.91778466 
          0.00848105 
       -189.63221442 
       4187.58753671 
        566.12348138 
        566.11500033 
        566.12065436 
   
  
  
      25.02   25.08
      25.03   25.08
   
        -63.29786752 
        -63.28754847 
        -63.29442784 
   
  
  
      25.22   25.31
      25.23   25.31
   
       -146.38955944 
       -146.36651905 
       -146.38187931 
   
  
  
      25.49   25.60
      25.50   25.61
   
       -150.13930368 
       -150.11652383 
       -150.13171040 
   
  
  
      27.69   27.82
      27.92   28.05
   
       -150.30283727 
       -150.28004922 
       -150.29524126 
   
  
  
      23.12   23.24
      24.42   24.56
   
       -148.82143443 
       -148.81382455 
       -148.81889780 
   
  
  
      22.62   22.73
      24.10   24.21
   
       -124.79599547 
       -124.81999577 
       -124.80399557 
   
  
  
      23.48   23.59
      24.66   24.78
   
       -119.11863978 
       -119.03179590 
       -119.08969182 
   
  
  
      23.48   23.57
      24.71   24.80
   
       -120.93706669 
       -120.95919108 
       -120.94444149 
   
  
  
      21.96   22.05
      23.03   23.12
   
       -120.97858939 
       -120.95838810 
       -120.97185562 
   
  
  
      23.16   23.26
      24.18   24.28
   
       -118.61143617 
       -118.64545918 
       -118.62277718 
   
  
  
      22.16   22.27
      23.25   23.37
   
       -124.48522171 
       -124.44696682 
       -124.47247008 
   
  
  
      23.06   23.17
      24.16   24.27
   
       -122.66087455 
       -122.66332900 
       -122.66169270 
   
  
  
      21.85   21.95
      22.89   23.00
   
       -124.79859693 
       -124.80568893 
       -124.80096093 
   
  
  
      21.35   21.46
      22.42   22.53
   
       -127.64091318 
       -127.65125039 
       -127.64435892 
   
  
  
      21.88   22.02
      22.93   23.08
   
       -130.64934108 
       -130.62508067 
       -130.64125427