vasp 
  6.2.1  
  16May21 (build Apr 11 2022 11:03:26) complex                          parallel 
  Lin64 
  2025 12 06 
  13:13:10 
 
 
  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 
    
   
   
           0.45349591       0.34092706       0.54718536 
           0.19116966       0.44258977       0.42370425 
           0.39584141       0.64487381       0.52978279 
           0.45275042       0.48807036       0.27097375 
           0.73037991       0.48418757       0.58941355 
           0.70942455       0.23910889       0.40267074 
           0.37579720       0.47865890       0.44304709 
           0.64111320       0.32122914       0.55785039 
           0.41477071       0.35245451       0.65004236 
           0.41312666       0.24439493       0.51142513 
           0.67109687       0.23077095       0.67409682 
           0.17459707       0.34552453       0.37440482 
           0.14201128       0.51997037       0.36270024 
           0.14045719       0.43967018       0.52136999 
           0.35123928       0.72599482       0.47367713 
           0.52089336       0.69306628       0.54105634 
           0.35576865       0.64369476       0.63154013 
           0.40035503       0.56279526       0.20929527 
           0.44601928       0.39138952       0.21873444 
           0.55897043       0.51671385       0.27453724 
           0.71693094       0.55506247       0.50631473 
           0.83847187       0.46692158       0.60107316 
           0.69429878       0.53287526       0.68123801 
           0.81838216       0.22575408       0.41098338 
           0.68974689       0.29907423       0.31256495 
           0.66471398       0.13970772       0.38732606 
           0.71080718       0.90477707       0.55109890 
   
  
  
           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 
   
  
  
          0.45349591       0.34092706       0.54718536 
          0.19116966       0.44258977       0.42370425 
          0.39584141       0.64487381       0.52978279 
          0.45275042       0.48807036       0.27097375 
          0.73037991       0.48418757       0.58941355 
          0.70942455       0.23910889       0.40267074 
          0.37579720       0.47865890       0.44304709 
          0.64111320       0.32122914       0.55785039 
          0.41477071       0.35245451       0.65004236 
          0.41312666       0.24439493       0.51142513 
          0.67109687       0.23077095       0.67409682 
          0.17459707       0.34552453       0.37440482 
          0.14201128       0.51997037       0.36270024 
          0.14045719       0.43967018       0.52136999 
          0.35123928       0.72599482       0.47367713 
          0.52089336       0.69306628       0.54105634 
          0.35576865       0.64369476       0.63154013 
          0.40035503       0.56279526       0.20929527 
          0.44601928       0.39138952       0.21873444 
          0.55897043       0.51671385       0.27453724 
          0.71693094       0.55506247       0.50631473 
          0.83847187       0.46692158       0.60107316 
          0.69429878       0.53287526       0.68123801 
          0.81838216       0.22575408       0.41098338 
          0.68974689       0.29907423       0.31256495 
          0.66471398       0.13970772       0.38732606 
          0.71080718       0.90477707       0.55109890 
  
 
 
  
       7.77    7.89
       8.00    8.12
   
          9.50327992 
       1072.34616390 
      -1969.70244896 
        102.69381879 
        867.92310589 
       -836.32164448 
         -0.01032424 
       -318.70819238 
       1325.98885632 
        253.71261475 
        253.72293899 
        253.71605617 
   
  
  
       9.79    9.81
       9.79    9.81
   
        -82.50842842 
        -82.49953234 
        -82.50546306 
   
  
  
       9.29    9.31
       9.29    9.31
   
       -146.78196638 
       -146.79816660 
       -146.78736645 
   
  
  
       9.85    9.87
       9.85    9.87
   
       -150.29138294 
       -150.30889639 
       -150.29722075 
   
  
  
       9.91    9.92
       9.97    9.98
   
       -150.39869563 
       -150.41621531 
       -150.40453552 
   
  
  
       8.20    8.22
       8.47    8.49
   
       -131.25954080 
       -131.26533924 
       -131.26147362 
   
  
  
       9.22    9.23
       9.49    9.50
   
       -133.32893806 
       -133.33474091 
       -133.33087234