vasp 
  6.2.1  
  16May21 (build Apr 11 2022 11:03:26) complex                          parallel 
  Lin64 
  2024 09 01 
  22:39:05 
 
 
  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
  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 
    
   
   
           0.93834228       0.53690918       0.07633511 
           0.85263712       0.30993344       0.39240004 
           0.13327418       0.45657959       0.17383728 
           0.14548552       0.31010427       0.32775961 
           0.82055782       0.32726137       0.03291856 
           0.95241040       0.45639344       0.51315913 
           0.09914057       0.33871944       0.12085048 
           0.17927813       0.42659176       0.37835434 
           0.89765773       0.57577346       0.56823593 
           0.77722684       0.25266258       0.86150479 
           0.12003262       0.52092350       0.67411833 
           0.01436891       0.22508422       0.72683962 
           0.91636389       0.34247730       0.59341832 
           0.86383649       0.43741994       0.95216182 
           0.17380619       0.33702629       0.71498773 
           0.11845151       0.43802481       0.82823705 
           0.43612056       0.45260344       0.12499348 
           0.33850229       0.23701422       0.44682370 
           0.71525403       0.48591601       0.18445234 
           0.56817270       0.28442655       0.33889327 
           0.33498321       0.31517232       0.99039092 
           0.45164080       0.43853375       0.47582654 
           0.55158640       0.33678297       0.14241254 
           0.72608941       0.42474849       0.37109480 
           0.40425061       0.54089406       0.58627466 
           0.28392690       0.23723078       0.82970403 
           0.65951431       0.54797849       0.70529943 
           0.55582679       0.21458860       0.72432925 
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           0.37422071       0.60766198       0.48455667 
           0.64537799       0.60696709       0.81618337 
           0.28696222       0.64179120       0.51206124 
           0.74394246       0.61205663       0.87340079 
   
  
  
           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 
          36 
  
 
 
  
          2        1        2 
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          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
      108
       -1
       -1
       142.00000000
        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
         -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
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        0
         0.50000000
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         0.00010000
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        1
        1
      256
        16.00000000
  
  
        2
         0.00001000
  
  
        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
        0
  
  
    F  
        -0.84910000
         0.12340000
         1.00000000
         0.00000000
  
  
        0
        27.21602676
         1.00000000
  
  
    F  
    F  
    F  
    F  
        0
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         0.00000000
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    F  
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    T  
    F  
    F  
    F  
    T  
        0
         0.00000000      0.00000000      0.00000000
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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
        -1.00000000
    F  
       -1
         0.00000000
        0
        0
       -1
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       -1
      200
        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 
   
  
  
          0.93834228       0.53690918       0.07633511 
          0.85263712       0.30993344       0.39240004 
          0.13327418       0.45657959       0.17383728 
          0.14548552       0.31010427       0.32775961 
          0.82055782       0.32726137       0.03291856 
          0.95241040       0.45639344       0.51315913 
          0.09914057       0.33871944       0.12085048 
          0.17927813       0.42659176       0.37835434 
          0.89765773       0.57577346       0.56823593 
          0.77722684       0.25266258       0.86150479 
          0.12003262       0.52092350       0.67411833 
          0.01436891       0.22508422       0.72683962 
          0.91636389       0.34247730       0.59341832 
          0.86383649       0.43741994       0.95216182 
          0.17380619       0.33702629       0.71498773 
          0.11845151       0.43802481       0.82823705 
          0.43612056       0.45260344       0.12499348 
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          0.71525403       0.48591601       0.18445234 
          0.56817270       0.28442655       0.33889327 
          0.33498321       0.31517232       0.99039092 
          0.45164080       0.43853375       0.47582654 
          0.55158640       0.33678297       0.14241254 
          0.72608941       0.42474849       0.37109480 
          0.40425061       0.54089406       0.58627466 
          0.28392690       0.23723078       0.82970403 
          0.65951431       0.54797849       0.70529943 
          0.55582679       0.21458860       0.72432925 
          0.41328125       0.33344395       0.57858568 
          0.39001489       0.42727728       0.91863403 
          0.66679184       0.33516856       0.70935476 
          0.64173392       0.44140504       0.80498079 
          0.37422071       0.60766198       0.48455667 
          0.64537799       0.60696709       0.81618337 
          0.28696222       0.64179120       0.51206124 
          0.74394246       0.61205663       0.87340079 
  
 
 
  
      10.41   10.45
      12.61   12.65
   
         27.86983208 
       9109.14696835 
     -12779.07930775 
       -236.10721847 
       3513.49417245 
      -2953.91778466 
          0.00255049 
       -210.54429683 
       4187.58753671 
        658.45245238 
        658.44990188 
        658.45160221 
   
  
  
      12.73   12.76
      12.73   12.76
   
        -88.33546443 
        -88.32150749 
        -88.33081212 
   
  
  
      12.35   12.38
      12.35   12.38
   
       -175.97284083 
       -175.96130660 
       -175.96899609 
   
  
  
      12.54   12.57
      12.54   12.57
   
       -178.96699281 
       -178.95730105 
       -178.96376222 
   
  
  
      13.46   13.51
      13.64   13.70
   
       -179.08941168 
       -179.07973484 
       -179.08618607 
   
  
  
      10.46   10.51
      12.06   12.11
   
       -146.13794709 
       -146.13495480 
       -146.13694966 
   
  
  
      11.04   11.10
      12.13   12.20
   
       -149.67419520 
       -149.67582529 
       -149.67473857 
   
  
  
      12.53   12.57
      13.59   13.64
   
       -150.53418052 
       -150.53929476 
       -150.53588527 
   
  
  
      11.47   11.54
      12.59   12.67
   
       -156.90604660 
       -156.89156365 
       -156.90121895 
   
  
  
      11.13   11.19
      12.13   12.19
   
       -160.54996708 
       -160.52288433 
       -160.54093950 
   
  
  
      10.92   10.97
      11.94   11.99
   
       -170.16705741 
       -170.15716759 
       -170.16376080 
   
  
  
      10.86   10.92
      11.92   11.97
   
       -176.78343823 
       -176.81532527 
       -176.79406725 
   
  
  
      11.14   11.23
      12.37   12.45
   
       -180.61534782 
       -180.65794002 
       -180.62954522 
   
  
  
      11.54   11.60
      12.80   12.87
   
       -181.81319410 
       -181.85402253 
       -181.82680357 
   
  
  
      11.36   11.41
      12.55   12.60
   
       -182.22567383 
       -182.26573841 
       -182.23902869