vasp 
  6.2.1  
  16May21 (build Apr 11 2022 11:03:26) complex                          parallel 
  Lin64 
  2024 09 02 
  15:23:10 
 
 
  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
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      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      0.00000000      0.10700000
  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 
    
   
   
           0.52694521       0.33292676       0.62516527 
           0.23167620       0.34134834       0.97446027 
           0.32420798       0.29775202       0.08410987 
           0.77567701       0.96330345       0.46860516 
           0.49355026       0.61937870       0.09113286 
           0.60205825       0.15578869       0.84721643 
           0.01386995       0.95149123       0.29689410 
           0.38807121       0.07316208       0.58966937 
           0.18299346       0.04631916       0.48695107 
           0.05685449       0.99790206       0.09703114 
           0.03333005       0.73707801       0.74989242 
           0.03515845       0.87217704       0.30830566 
           0.63206361       0.51285122       0.62992907 
           0.02791548       0.68678503       0.62499868 
           0.43275060       0.97828271       0.83602444 
           0.99940780       0.77375342       0.43260055 
           0.92070129       0.88608727       0.26721996 
           0.68359408       0.94901249       0.46919627 
           0.18525418       0.56740318       0.49443904 
           0.81859719       0.27675380       0.48605207 
           0.30909213       0.97786621       0.06675584 
           0.79630991       0.96878533       0.49223293 
           0.37323508       0.21362868       0.84638686 
           0.66045697       0.44449282       0.54481328 
           0.59472836       0.68713713       0.13863404 
           0.50618675       0.16181843       0.17519714 
           0.12913508       0.96245673       0.49063625 
           0.72364138       0.53076781       0.04120142 
           0.25001311       0.49650295       0.66040967 
           0.66869856       0.12692269       0.51197809 
           0.75593930       0.69454703       0.73753237 
           0.23550718       0.24632558       0.85668781 
           0.09211944       0.60804686       0.11531104 
           0.35198847       0.10223582       0.33711612 
           0.57589603       0.83164810       0.00717660 
   
  
  
           1 
           2 
           3 
           4 
           5 
           6 
           7 
           8 
           9 
          10 
          11 
          12 
          13 
          14 
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          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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          0.50000000       0.00000000       0.50000000 
  
  
          0.25000000 
          0.25000000 
          0.25000000 
          0.25000000 
  
 
 
  
   No title
    F  
  
  
   normal
       400.00000000
       605.39200000
         0.00001000
       38
       10
       88
       -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  
          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      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      0.00000000      0.00000000      0.00000000      0.00000000      0.00000000      0.00000000      0.00000000      0.00000000      0.10700000
         -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
           0.00000003
           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      0.73000000      0.32000000
      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
  
  
        4
        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
         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
    O    2
    H    3
    H    3
   
  
  
   type
   atomspertype
   element
   mass
   valence
   pseudopotential
   
      32Si     28.08500000      4.00000000  PAW_PBE Si 05Jan2001                  
       1O      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 
   
  
  
          0.52694521       0.33292676       0.62516527 
          0.23167620       0.34134834       0.97446027 
          0.32420798       0.29775202       0.08410987 
          0.77567701       0.96330345       0.46860516 
          0.49355026       0.61937870       0.09113286 
          0.60205825       0.15578869       0.84721643 
          0.01386995       0.95149123       0.29689410 
          0.38807121       0.07316208       0.58966937 
          0.18299346       0.04631916       0.48695107 
          0.05685449       0.99790206       0.09703114 
          0.03333005       0.73707801       0.74989242 
          0.03515845       0.87217704       0.30830566 
          0.63206361       0.51285122       0.62992907 
          0.02791548       0.68678503       0.62499868 
          0.43275060       0.97828271       0.83602444 
          0.99940780       0.77375342       0.43260055 
          0.92070129       0.88608727       0.26721996 
          0.68359408       0.94901249       0.46919627 
          0.18525418       0.56740318       0.49443904 
          0.81859719       0.27675380       0.48605207 
          0.30909213       0.97786621       0.06675584 
          0.79630991       0.96878533       0.49223293 
          0.37323508       0.21362868       0.84638686 
          0.66045697       0.44449282       0.54481328 
          0.59472836       0.68713713       0.13863404 
          0.50618675       0.16181843       0.17519714 
          0.12913508       0.96245673       0.49063625 
          0.72364138       0.53076781       0.04120142 
          0.25001311       0.49650295       0.66040967 
          0.66869856       0.12692269       0.51197809 
          0.75593930       0.69454703       0.73753237 
          0.23550718       0.24632558       0.85668781 
          0.09211944       0.60804686       0.11531104 
          0.35198847       0.10223582       0.33711612 
          0.57589603       0.83164810       0.00717660 
  
 
 
  
       6.02    6.07
       6.52    6.57
   
         24.76344702 
       -306.48339462 
      -2086.90735911 
       -292.52817866 
       3170.77583059 
      -2609.60722799 
          0.00322421 
       -199.90912450 
       3755.32434067 
       1455.43155762 
       1455.42833341 
       1455.43048288 
   
  
  
       8.31    8.37
       8.32    8.37
   
        734.29855435 
        734.31919957 
        734.30543609 
   
  
  
       9.41    9.48
       9.41    9.48
   
        519.42283549 
        519.45355045 
        519.43307381 
   
  
  
       7.78    7.85
       7.78    7.85
   
        497.02475847 
        497.04227713 
        497.03059802 
   
  
  
       8.11    8.18
       8.22    8.30
   
        496.14754124 
        496.16194977 
        496.15234408 
   
  
  
       8.25    8.31
       8.81    8.87
   
        598.74997143 
        598.73977022 
        598.74657103 
   
  
  
       8.20    8.27
       8.77    8.84
   
        584.13920804 
        584.15365686 
        584.14402431 
   
  
  
       7.91    7.97
       8.47    8.53
   
        635.37311036 
        635.36698138 
        635.37106737 
   
  
  
       7.54    7.59
       8.10    8.16
   
        613.32938943 
        613.32246270 
        613.32708052 
   
  
  
       7.46    7.52
       8.03    8.09
   
        613.10487665 
        613.10134630 
        613.10369987 
   
  
  
       7.76    7.81
       8.32    8.38
   
        627.43910822 
        627.46368513 
        627.44730053 
   
  
  
       7.32    7.38
       7.89    7.95
   
        623.95192650 
        623.95307719 
        623.95231006 
   
  
  
       8.65    8.71
       9.21    9.28
   
        622.48722764 
        622.48674843 
        622.48706790 
   
  
  
       7.78    7.84
       8.34    8.40
   
        627.46714799 
        627.51162489 
        627.48197362 
   
  
  
       7.31    7.37
       7.88    7.93
   
        639.40575889 
        639.43348535 
        639.41500104 
   
  
  
       8.25    8.32
       8.82    8.90
   
        639.14076940 
        639.14098919 
        639.14084266 
   
  
  
       7.71    7.77
       8.30    8.36
   
        628.24619282 
        628.24374958 
        628.24537841 
   
  
  
       7.42    7.48
       8.01    8.07
   
        630.58418934 
        630.58347315 
        630.58395061 
   
  
  
       8.26    8.31
       8.84    8.89
   
        640.27315524 
        640.23994197 
        640.26208415 
   
  
  
       5.93    5.98
       6.50    6.55
   
        689.58810952 
        689.57279972 
        689.58300625 
   
  
  
       7.40    7.45
       7.97    8.03
   
      -8391.82393290 
      -8391.80236826 
      -8391.81674469 
   
  
  
       7.45    7.51
       8.03    8.10
   
      -2347.77550888 
      -2347.78947224 
      -2347.78016333 
   
  
  
       7.91    7.96
       8.48    8.54
   
     -58775.14184916 
     -58775.11572159 
     -58775.13313997 
   
  
  
       6.92    6.97
       7.50    7.56
   
     -62925.59150731 
     -62925.56583601 
     -62925.58295021 
   
  
  
       8.73    8.78
       9.30    9.36
   
    -901403.32152810 
    -901403.29525436 
    -901403.31277019