vasp 
  6.2.1  
  16May21 (build Apr 11 2022 11:03:26) complex                          parallel 
  Lin64 
  2025 12 01 
  23:31:44 
 
 
  No title
       0
  Normal
  Normal (blocked Davidson)
   F  
       1
       2
       1
     200
       2
      -1
        0.00001000
       -0.02000000
       0
       2
       1
      400.00000000
        0.77000000      0.72000000      0.32000000
  Auto
       1
        0.20000000
       1
   F  
   F  
       1
 
 
  
   
    
           10.00000000       0.00000000       0.00000000 
            0.00000000       8.00000000       0.00000000 
            0.00000000       0.00000000       8.00000000 
    
        640.00000000 
    
            0.10000000       0.00000000       0.00000000 
            0.00000000       0.12500000       0.00000000 
            0.00000000       0.00000000       0.12500000 
    
   
   
           0.36451751       0.12506151       0.39436382 
           0.50372872       0.94669324       0.17324078 
           0.91017452       0.37996033       0.68342831 
           0.32158463       0.47059480       0.01950980 
           0.53325061       0.56213634       0.65278793 
           0.00163599       0.38174921       0.81507907 
           0.28520171       0.78398360       0.38740318 
           0.30152796       0.86389850       0.98558954 
           0.02141358       0.25337367       0.16743891 
           0.54692800       0.21759473       0.50300652 
           0.42973920       0.75576661       0.59832637 
           0.46558659       0.94911242       0.54429423 
   
  
  
           1 
           2 
           3 
           4 
           5 
           6 
           7 
           8 
           9 
          10 
          11 
          12 
  
 
 
  
          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 
          0.50000000       0.00000000       0.50000000 
          0.00000000       0.50000000       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
        63.00000000
        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
   
   
         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
     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
       40
       40
      100
       80
       80
    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      0.72000000      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     18.99800000      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
        32.00000000
         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  
  
 
 
        12 
         3 
  
   ion
   element
   atomtype
   
    C    1
    C    1
    C    1
    F    2
    F    2
    F    2
    F    2
    F    2
    F    2
    F    2
    H    3
    H    3
   
  
  
   type
   atomspertype
   element
   mass
   valence
   pseudopotential
   
       3C      12.01100000      4.00000000  PAW_PBE C 08Apr2002                   
       7F      18.99800000      7.00000000  PAW_PBE F 08Apr2002                   
       2H       1.00000000      1.00000000  PAW_PBE H 15Jun2001                   
   
  
 
 
  
   
          10.00000000       0.00000000       0.00000000 
           0.00000000       8.00000000       0.00000000 
           0.00000000       0.00000000       8.00000000 
   
       640.00000000 
   
           0.10000000       0.00000000       0.00000000 
           0.00000000       0.12500000       0.00000000 
           0.00000000       0.00000000       0.12500000 
   
  
  
          0.36451751       0.12506151       0.39436382 
          0.50372872       0.94669324       0.17324078 
          0.91017452       0.37996033       0.68342831 
          0.32158463       0.47059480       0.01950980 
          0.53325061       0.56213634       0.65278793 
          0.00163599       0.38174921       0.81507907 
          0.28520171       0.78398360       0.38740318 
          0.30152796       0.86389850       0.98558954 
          0.02141358       0.25337367       0.16743891 
          0.54692800       0.21759473       0.50300652 
          0.42973920       0.75576661       0.59832637 
          0.46558659       0.94911242       0.54429423 
  
  
     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 
     F  F  F 
  
  
         -3.00000000       0.00000000       0.00010000       0.00010000 
  
 
 
  
       2.52    2.93
       2.58    2.99
   
         23.83307581 
      -1382.47150813 
      -3104.42118925 
        291.27259277 
       4104.28886790 
      -4141.72589677 
         -0.01750962 
       -324.84908422 
       5082.48689363 
        548.39624213 
        548.41375174 
        548.40207866 
   
  
  
       4.82    4.83
       4.82    4.83
   
         50.78401383 
         50.79100646 
         50.78634471 
   
  
  
       4.26    4.27
       4.26    4.27
   
        -41.89051198 
        -41.83776375 
        -41.87292924 
   
  
  
       4.45    4.46
       4.45    4.46
   
        -44.42099506 
        -44.36510027 
        -44.40236347 
   
  
  
       4.59    4.59
       4.61    4.62
   
        -44.49590723 
        -44.43994698 
        -44.47725381 
   
  
  
       4.07    4.08
       4.15    4.16
   
        -52.30741928 
        -52.16573517 
        -52.26019124 
   
  
  
       4.01    4.01
       4.09    4.09
   
        -36.32650172 
        -36.31214391 
        -36.32171578 
   
  
  
       4.31    4.32
       4.39    4.40
   
        -33.23970162 
        -33.17766495 
        -33.21902273 
   
  
  
       3.97    3.97
       4.04    4.04
   
        -31.55256364 
        -31.51861917 
        -31.54124882 
   
  
  
       4.33    4.34
       4.41    4.42
   
        -30.16210569 
        -30.14498936 
        -30.15640024 
   
  
  
       4.26    4.28
       4.34    4.36
   
        -29.88137886 
        -29.83358970 
        -29.86544914 
   
  
  
       4.10    4.11
       4.17    4.18
   
        -28.23519491 
        -28.21137300 
        -28.22725427 
   
  
  
       3.96    3.96
       4.03    4.03
   
        -26.46443058 
        -26.37866535 
        -26.43584217 
   
  
  
       4.47    4.48
       4.55    4.55
   
        -26.09588637 
        -25.98325366 
        -26.05834213 
   
  
  
       3.83    3.84
       3.91    3.91
   
        -26.08534632 
        -25.96796002 
        -26.04621755 
   
  
  
       3.71    3.71
       3.78    3.78
   
        -25.96111252 
        -25.84808398 
        -25.92343634 
   
  
  
       3.79    3.79
       3.88    3.88
   
        -25.66615978 
        -25.57110701 
        -25.63447552 
   
  
  
       4.14    4.14
       4.22    4.22
   
        -25.83827893 
        -25.54325060 
        -25.73993615 
   
  
  
       4.63    4.63
       4.71    4.71
   
        -25.75709815 
        -25.73062580 
        -25.74827403 
   
  
  
       4.20    4.21
       4.28    4.29
   
        -26.44288226 
        -26.31724787 
        -26.40100413 
   
  
  
       3.70    3.70
       3.77    3.78
   
        -25.99112071 
        -25.86061729 
        -25.94761957 
   
  
  
       3.91    3.91
       3.99    3.99
   
        -25.70120731 
        -25.62101736 
        -25.67447733 
   
  
  
       4.10    4.10
       4.17    4.18
   
        -25.86620376 
        -25.78980057 
        -25.84073603