vasp 
  6.2.1  
  16May21 (build Apr 11 2022 11:03:26) complex                          parallel 
  Lin64 
  2025 12 06 
  13:13:13 
 
 
  No title
       0
  Normal
  Normal (blocked Davidson)
   F  
       2
       2
       1
     200
       2
      -1
        0.00001000
       -0.02000000
       0
       2
       1
      400.00000000
        0.77000000      1.11000000      0.32000000
       -0.00200000     -0.00100000      0.00100000      0.00000000      0.00000000      0.00100000     -0.00100000      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
  Auto
       1
        0.20000000
       1
   F  
   F  
       1
 
 
  
   
    
           10.00000000       0.00000000       0.00000000 
            0.00000000      10.00000000       0.00000000 
            0.00000000       0.00000000      10.00000000 
    
       1000.00000000 
    
            0.10000000       0.00000000       0.00000000 
            0.00000000       0.10000000       0.00000000 
            0.00000000       0.00000000       0.10000000 
    
   
   
           0.44866145       0.33763512       0.54725172 
           0.18676360       0.43906127       0.42272098 
           0.39202417       0.63939668       0.52949420 
           0.44853152       0.48574055       0.27050584 
           0.72432085       0.48176339       0.58917084 
           0.70455957       0.23566056       0.40282892 
           0.37158882       0.47518075       0.44254170 
           0.63625554       0.31813362       0.55791925 
           0.41002564       0.35035907       0.65001239 
           0.40788757       0.24104288       0.51216901 
           0.66649844       0.22755760       0.67399712 
           0.17103065       0.34132982       0.37436176 
           0.13785923       0.51570938       0.36066587 
           0.13578672       0.43707849       0.52024689 
           0.37593913       0.72789724       0.47511996 
           0.59766901       0.76262665       0.54384899 
           0.37033663       0.64396798       0.63492810 
           0.39543205       0.56027973       0.20923484 
           0.44263311       0.38921125       0.21789162 
           0.55443250       0.51539044       0.27443878 
           0.70808857       0.55295343       0.50685156 
           0.83282025       0.46591259       0.59880287 
           0.68907584       0.52939283       0.68187367 
           0.81361483       0.22281133       0.41088674 
           0.68433223       0.29491742       0.31235555 
           0.66028381       0.13592593       0.38829499 
           0.70617812       0.90332189       0.54969283 
   
  
  
           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 
  
 
 
  
          2        2        2 
         0.00000000       0.00000000       0.00000000 
         0.50000000       0.00000000       0.00000000 
         0.00000000       0.50000000       0.00000000 
         0.00000000       0.00000000       0.50000000 
         0.00000000       0.00000000       0.00000000 
  
  
          0.00000000       0.00000000       0.00000000 
          0.50000000       0.00000000       0.00000000 
          0.00000000       0.50000000       0.00000000 
          0.00000000       0.00000000       0.50000000 
          0.50000000       0.50000000       0.00000000 
          0.00000000       0.50000000       0.50000000 
          0.50000000       0.00000000       0.50000000 
          0.50000000       0.50000000       0.50000000 
  
  
          0.12500000 
          0.12500000 
          0.12500000 
          0.12500000 
          0.12500000 
          0.12500000 
          0.12500000 
          0.12500000 
  
 
 
  
   No title
    F  
  
  
   normal
       400.00000000
       644.87300000
         0.00001000
       38
       10
       40
       -1
       -1
        51.00000000
        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  
         -0.00200000     -0.00100000      0.00100000      0.00000000      0.00000000      0.00100000     -0.00100000      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
           0.00000006
           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
   
  
  
       50
       50
       50
      100
      100
      100
    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
         0.77000000      1.11000000      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  
        12.01100000     28.08500000      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
        22.22222222
         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
      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  
  
 
 
        27 
         3 
  
   ion
   element
   atomtype
   
    C    1
    C    1
    C    1
    C    1
    C    1
    C    1
    Si   2
    Si   2
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
   
  
  
   type
   atomspertype
   element
   mass
   valence
   pseudopotential
   
       6C      12.01100000      4.00000000  PAW_PBE C 08Apr2002                   
       2Si     28.08500000      4.00000000  PAW_PBE Si 05Jan2001                  
      19H       1.00000000      1.00000000  PAW_PBE H 15Jun2001                   
   
  
 
 
  
   
          10.00000000       0.00000000       0.00000000 
           0.00000000      10.00000000       0.00000000 
           0.00000000       0.00000000      10.00000000 
   
      1000.00000000 
   
           0.10000000       0.00000000       0.00000000 
           0.00000000       0.10000000       0.00000000 
           0.00000000       0.00000000       0.10000000 
   
  
  
          0.44866145       0.33763512       0.54725172 
          0.18676360       0.43906127       0.42272098 
          0.39202417       0.63939668       0.52949420 
          0.44853152       0.48574055       0.27050584 
          0.72432085       0.48176339       0.58917084 
          0.70455957       0.23566056       0.40282892 
          0.37158882       0.47518075       0.44254170 
          0.63625554       0.31813362       0.55791925 
          0.41002564       0.35035907       0.65001239 
          0.40788757       0.24104288       0.51216901 
          0.66649844       0.22755760       0.67399712 
          0.17103065       0.34132982       0.37436176 
          0.13785923       0.51570938       0.36066587 
          0.13578672       0.43707849       0.52024689 
          0.37593913       0.72789724       0.47511996 
          0.59766901       0.76262665       0.54384899 
          0.37033663       0.64396798       0.63492810 
          0.39543205       0.56027973       0.20923484 
          0.44263311       0.38921125       0.21789162 
          0.55443250       0.51539044       0.27443878 
          0.70808857       0.55295343       0.50685156 
          0.83282025       0.46591259       0.59880287 
          0.68907584       0.52939283       0.68187367 
          0.81361483       0.22281133       0.41088674 
          0.68433223       0.29491742       0.31235555 
          0.66028381       0.13592593       0.38829499 
          0.70617812       0.90332189       0.54969283 
  
 
 
  
       8.37    8.45
       8.64    8.72
   
          9.50327992 
       1044.66807962 
      -1944.85143378 
        102.25594949 
        867.92310589 
       -836.32164448 
         -0.01015777 
       -317.05243020 
       1325.98885632 
        252.10360499 
        252.11376276 
        252.10699092 
   
  
  
       9.83    9.84
       9.84    9.85
   
        -79.85085249 
        -79.83903119 
        -79.84691205 
   
  
  
       9.29    9.31
       9.29    9.31
   
       -144.07943224 
       -144.05467121 
       -144.07117856 
   
  
  
       9.81    9.84
       9.81    9.84
   
       -147.72236318 
       -147.69721542 
       -147.71398059 
   
  
  
       9.82    9.86
       9.87    9.91
   
       -147.83800215 
       -147.81282652 
       -147.82961027 
   
  
  
       8.95    8.97
       9.21    9.24
   
       -132.74360996 
       -132.74954314 
       -132.74558769 
   
  
  
       9.66    9.68
       9.93    9.95
   
       -130.83570259 
       -130.84151408 
       -130.83763976