vasp 
  6.2.1  
  16May21 (build Apr 11 2022 11:03:26) complex                          parallel 
  Lin64 
  2025 11 30 
  15:22:45 
 
 
  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 
    
   
   
           0.38458149       0.42246618       0.54132868 
           0.43613787       0.57025701       0.43575501 
           0.57174435       0.54206088       0.34827646 
           0.34162135       0.60594247       0.31433972 
           0.26403765       0.46326845       0.60778841 
           0.36893518       0.28119450       0.44993820 
           0.60600022       0.68295442       0.26348733 
           0.66915706       0.51053666       0.46218479 
           0.56772943       0.41416217       0.23771897 
           0.46994249       0.38950772       0.66912996 
           0.44694858       0.67955077       0.51931123 
           0.51643075       0.94331647       0.48592248 
   
  
  
           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 
   
  
  
          0.38458149       0.42246618       0.54132868 
          0.43613787       0.57025701       0.43575501 
          0.57174435       0.54206088       0.34827646 
          0.34162135       0.60594247       0.31433972 
          0.26403765       0.46326845       0.60778841 
          0.36893518       0.28119450       0.44993820 
          0.60600022       0.68295442       0.26348733 
          0.66915706       0.51053666       0.46218479 
          0.56772943       0.41416217       0.23771897 
          0.46994249       0.38950772       0.66912996 
          0.44694858       0.67955077       0.51931123 
          0.51643075       0.94331647       0.48592248 
  
  
     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 
  
 
 
  
       1.95    2.68
       2.01    2.74
   
         23.83307581 
       1654.82207157 
      -6014.61016088 
        304.45320933 
       4104.28886790 
      -4141.72589677 
         -0.02040692 
       -406.67239410 
       5082.48689363 
        606.85525957 
        606.87566649 
        606.86206187 
   
  
  
       4.17    4.19
       4.17    4.19
   
         36.48618607 
         36.50871839 
         36.49369684 
   
  
  
       4.20    4.20
       4.20    4.20
   
        -60.68231443 
        -60.62681374 
        -60.66381420 
   
  
  
       4.27    4.28
       4.27    4.28
   
        -62.33822500 
        -62.28271646 
        -62.31972216 
   
  
  
       4.49    4.50
       4.51    4.52
   
        -62.37989613 
        -62.32435519 
        -62.36138248 
   
  
  
       4.30    4.31
       4.37    4.38
   
        -59.58779718 
        -59.53252826 
        -59.56937421 
   
  
  
       4.49    4.49
       4.56    4.57
   
        -59.40861594 
        -59.35338958 
        -59.39020715 
   
  
  
       4.23    4.23
       4.30    4.30
   
        -59.40313329 
        -59.34793284 
        -59.38473314 
   
  
  
       4.24    4.24
       4.31    4.31
   
        -59.40456311 
        -59.34936525 
        -59.38616382 
   
  
  
       4.50    4.50
       4.57    4.57
   
        -59.40485981 
        -59.34965339 
        -59.38645767 
   
  
  
       4.16    4.16
       4.23    4.23
   
        -59.40540023 
        -59.35019456 
        -59.38699834 
   
  
  
       4.06    4.07
       4.13    4.14
   
        -59.40598796 
        -59.35078169 
        -59.38758587 
   
  
  
       3.86    3.86
       3.93    3.94
   
        -59.40647241 
        -59.35126603 
        -59.38807028 
   
  
  
       3.80    3.80
       3.87    3.88
   
        -59.40674866 
        -59.35154245 
        -59.38834659 
   
  
  
       3.28    3.29
       3.36    3.37
   
        -59.40683389 
        -59.35162753 
        -59.38843177 
   
  
  
       3.17    3.18
       3.24    3.25
   
        -59.40689605 
        -59.35168964 
        -59.38849391 
   
  
  
       3.13    3.14
       3.23    3.23
   
        -59.40690895 
        -59.35170261 
        -59.38850684 
   
  
  
       2.92    2.92
       2.99    3.00
   
        -59.40692297 
        -59.35171665 
        -59.38852086 
   
  
  
       2.99    3.00
       3.04    3.06
   
         23.83307581 
       1654.82207157 
      -6082.62868374 
        309.56633971 
       5655.12619840 
      -5692.65647537 
         -0.05520637 
      -1009.90114174 
       5082.48689363 
        -59.40692811 
        -59.35172174 
        -59.38852599