vasp 
  6.2.1  
  16May21 (build Apr 11 2022 11:03:26) complex                          parallel 
  Lin64 
  2024 08 17 
  00:12:43 
 
 
  No title
       0
  Normal
  Normal (blocked Davidson)
   F  
       1
       2
       1
      95
       2
      -1
        0.00001000
       -0.02000000
       0
       2
       1
      400.00000000
        1.11000000      0.73000000      0.77000000      0.32000000
  Auto
       1
        0.20000000
       1
   F  
   F  
       1
 
 
  
   
    
           20.00000000       0.00000000       0.00000000 
            0.00000000      15.00000000       0.00000000 
            0.00000000       0.00000000      15.00000000 
    
       4500.00000000 
    
            0.05000000       0.00000000       0.00000000 
            0.00000000       0.06666667       0.00000000 
            0.00000000       0.00000000       0.06666667 
    
   
   
           0.36942463       0.49290303       0.48545537 
           0.35962671       0.56612788       0.40690362 
           0.44742177       0.49824577       0.51058132 
           0.34215913       0.39313364       0.46147884 
           0.31944033       0.51864396       0.57636059 
           0.29757424       0.58474086       0.36351938 
           0.47812047       0.45441235       0.58513173 
           0.37063571       0.34056200       0.39079112 
           0.31456017       0.59561003       0.61235596 
           0.27602182       0.52436914       0.33304783 
           0.26085852       0.61271343       0.41083442 
           0.30707906       0.63404946       0.31096554 
           0.46119563       0.38473341       0.59134189 
           0.53243598       0.45494772       0.57468076 
           0.46673719       0.49002182       0.64743990 
           0.34472320       0.27606591       0.39026813 
           0.36373346       0.37311486       0.32560848 
           0.42444040       0.32927264       0.40156108 
           0.43354561       0.67326197       0.63853714 
           0.32766310       0.65777079       0.57544634 
           0.28069565       0.60037467       0.67027163 
           0.51315783       0.73239050       0.60092693 
   
  
  
           1 
           2 
           3 
           4 
           5 
           6 
           7 
           8 
           9 
          10 
          11 
          12 
          13 
          14 
          15 
          16 
          17 
          18 
          19 
          20 
          21 
          22 
  
 
 
  
          1        1        1 
         0.00000000       0.00000000       0.00000000 
         1.00000000       0.00000000       0.00000000 
         0.00000000       1.00000000       0.00000000 
         0.00000000       0.00000000       1.00000000 
         0.00000000       0.00000000       0.00000000 
  
  
          0.00000000       0.00000000       0.00000000 
  
  
          1.00000000 
  
 
 
  
   No title
    F  
  
  
   normal
       400.00000000
       644.87300000
         0.00001000
       38
       10
       42
       -1
       -1
        57.00000000
        0
        0
        0
        0
         0.00000000
   
         1
          0.20000000
          0.50000000
     T  
     T  
   
   
     T  
         -0.00050000     -0.00050000     -0.00050000     -0.00050000
      -100
         2
     F  
   
   
         0
         2
         1
   
   
         1
     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
     F  
          0.00000000      0.00000000      1.00000000
     F  
          0.00000000      0.00000000      0.00000000
     F  
   
   
     F  
     F  
   
   
        95
        -5
         2
        400.00000000
    
      T  
      F  
           0.00000000
           0.00000006
           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
   
  
  
       98
       80
       80
      196
      160
      160
    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      0.77000000      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
  
  
        3
        4
       -1
    T  
    F  
    F  
    F  
    F  
    F  
  
  
        3
       -1
    F  
        28.08500000     16.00000000     12.01100000      1.00000000
         0.00000000      0.00000000      0.00000000      0.00000000
         1.00000000      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
       122.72727273
         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
       95
        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  
  
 
 
        22 
         4 
  
   ion
   element
   atomtype
   
    Si   1
    O    2
    O    2
    O    2
    O    2
    C    3
    C    3
    C    3
    C    3
    H    4
    H    4
    H    4
    H    4
    H    4
    H    4
    H    4
    H    4
    H    4
    H    4
    H    4
    H    4
    H    4
   
  
  
   type
   atomspertype
   element
   mass
   valence
   pseudopotential
   
       1Si     28.08500000      4.00000000  PAW_PBE Si 05Jan2001                  
       4O      16.00000000      6.00000000  PAW_PBE O 08Apr2002                   
       4C      12.01100000      4.00000000  PAW_PBE C 08Apr2002                   
      13H       1.00000000      1.00000000  PAW_PBE H 15Jun2001                   
   
  
 
 
  
   
          20.00000000       0.00000000       0.00000000 
           0.00000000      15.00000000       0.00000000 
           0.00000000       0.00000000      15.00000000 
   
      4500.00000000 
   
           0.05000000       0.00000000       0.00000000 
           0.00000000       0.06666667       0.00000000 
           0.00000000       0.00000000       0.06666667 
   
  
  
          0.36942463       0.49290303       0.48545537 
          0.35962671       0.56612788       0.40690362 
          0.44742177       0.49824577       0.51058132 
          0.34215913       0.39313364       0.46147884 
          0.31944033       0.51864396       0.57636059 
          0.29757424       0.58474086       0.36351938 
          0.47812047       0.45441235       0.58513173 
          0.37063571       0.34056200       0.39079112 
          0.31456017       0.59561003       0.61235596 
          0.27602182       0.52436914       0.33304783 
          0.26085852       0.61271343       0.41083442 
          0.30707906       0.63404946       0.31096554 
          0.46119563       0.38473341       0.59134189 
          0.53243598       0.45494772       0.57468076 
          0.46673719       0.49002182       0.64743990 
          0.34472320       0.27606591       0.39026813 
          0.36373346       0.37311486       0.32560848 
          0.42444040       0.32927264       0.40156108 
          0.43354561       0.67326197       0.63853714 
          0.32766310       0.65777079       0.57544634 
          0.28069565       0.60037467       0.67027163 
          0.51315783       0.73239050       0.60092693 
  
  
     T  T  T 
     T  T  T 
     T  T  T 
     T  T  T 
     T  T  T 
     T  T  T 
     T  T  T 
     T  T  T 
     T  T  T 
     T  T  T 
     T  T  T 
     T  T  T 
     T  T  T 
     T  T  T 
     T  T  T 
     T  T  T 
     T  T  T 
     T  T  T 
     T  T  T 
     T  T  T 
     T  T  T 
     F  F  F 
  
  
         -3.00000000       0.00000000       0.00010000       0.00010000 
  
 
 
  
       1.50    1.52
       6.81    6.83
   
          2.72167375 
       4013.58564841 
      -5951.53326831 
        183.74446048 
       1936.15224937 
      -1928.14668463 
         -0.03457763 
       -324.66813093 
       2582.84965050 
        514.67102100 
        514.70559863 
        514.68254688 
   
  
  
       1.55    1.56
       1.56    1.56
   
        138.79637731 
        138.81727349 
        138.80334270 
   
  
  
       1.33    1.33
       1.33    1.33
   
        -84.86722255 
        -84.81080359 
        -84.84841623 
   
  
  
       1.33    1.34
       1.33    1.34
   
       -122.23500209 
       -122.17858314 
       -122.21619578 
   
  
  
       1.27    1.28
       1.88    1.89
   
       -123.44985261 
       -123.39343365 
       -123.43104629 
   
  
  
       1.02    1.03
       6.90    6.90
   
       -114.80039094 
       -114.74397198 
       -114.78158462 
   
  
  
       0.87    0.88
       6.73    6.74
   
       -113.45859399 
       -113.40217503 
       -113.43978767 
   
  
  
       0.70    0.70
       6.62    6.63
   
       -113.04851060 
       -112.99209164 
       -113.02970428 
   
  
  
       0.57    0.58
       6.58    6.58
   
       -112.92028422 
       -112.86386526 
       -112.90147790 
   
  
  
       0.63    0.63
       6.59    6.60
   
       -112.89853132 
       -112.84211236 
       -112.87972500 
   
  
  
       0.65    0.65
       6.65    6.65
   
       -112.89132961 
       -112.83491065 
       -112.87252329 
   
  
  
       0.69    0.69
       6.77    6.77
   
       -112.89080663 
       -112.83438767 
       -112.87200031 
   
  
  
       0.56    0.56
       6.65    6.65
   
       -112.89395174 
       -112.83753278 
       -112.87514542 
   
  
  
       0.60    0.60
       6.81    6.81
   
       -112.90245067 
       -112.84603171 
       -112.88364435 
   
  
  
       0.67    0.68
       6.81    6.81
   
       -112.90868803 
       -112.85226907 
       -112.88988171 
   
  
  
       0.73    0.73
       6.97    6.97
   
       -112.91252023 
       -112.85610127 
       -112.89371391 
   
  
  
       0.58    0.58
       6.80    6.81
   
       -112.91725942 
       -112.86084046 
       -112.89845310 
   
  
  
       0.70    0.70
       7.08    7.08
   
       -112.91933230 
       -112.86291334 
       -112.90052598 
   
  
  
       0.58    0.58
       6.94    6.94
   
       -112.92030922 
       -112.86389027 
       -112.90150290 
   
  
  
       0.41    0.46
       6.01    6.05
   
       -112.92094468 
       -112.86452572 
       -112.90213836