vasp 
  6.2.1  
  16May21 (build Apr 11 2022 11:03:26) complex                          parallel 
  Lin64 
  2025 11 30 
  21:43:14 
 
 
  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 
    
   
   
           0.41653678       0.48364551       0.56795901 
           0.44921182       0.36724422       0.30658151 
           0.57982541       0.54809825       0.36584848 
           0.33951229       0.69365984       0.32215594 
           0.28100946       0.51823007       0.63095687 
           0.43146043       0.45658526       0.40466632 
           0.65436264       0.69516850       0.27202390 
           0.69941017       0.55368491       0.47629260 
           0.48240660       0.43715469       0.29901048 
           0.45004394       0.45038026       0.74185695 
           0.41463119       0.44565778       0.37265726 
           0.44997951       0.86856523       0.55783273 
   
  
  
           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 
   
  
  
          0.41653678       0.48364551       0.56795901 
          0.44921182       0.36724422       0.30658151 
          0.57982541       0.54809825       0.36584848 
          0.33951229       0.69365984       0.32215594 
          0.28100946       0.51823007       0.63095687 
          0.43146043       0.45658526       0.40466632 
          0.65436264       0.69516850       0.27202390 
          0.69941017       0.55368491       0.47629260 
          0.48240660       0.43715469       0.29901048 
          0.45004394       0.45038026       0.74185695 
          0.41463119       0.44565778       0.37265726 
          0.44997951       0.86856523       0.55783273 
  
 
 
  
       4.41    4.49
       4.47    4.55
   
         23.83307581 
       2669.42123636 
      -6576.30037396 
        313.37394505 
       4104.28886790 
      -4141.72589677 
         -0.01364860 
       -645.00281654 
       5082.48689363 
        830.36128289 
        830.37493149 
        830.36583242 
   
  
  
       5.67    5.68
       5.67    5.68
   
        275.25061216 
        275.25176550 
        275.25099661 
   
  
  
       4.76    4.77
       4.76    4.77
   
        173.22342249 
        173.26326971 
        173.23670490 
   
  
  
       4.66    4.67
       4.66    4.67
   
        168.90868418 
        168.96446193 
        168.92727676 
   
  
  
       4.51    4.51
       4.53    4.53
   
        168.82485932 
        168.88058051 
        168.84343305 
   
  
  
       4.37    4.37
       4.46    4.46
   
        182.71052389 
        182.76469728 
        182.72858168 
   
  
  
       4.47    4.48
       4.55    4.55
   
        179.41658646 
        179.45245101 
        179.42854131 
   
  
  
       4.36    4.36
       4.43    4.43
   
        186.03303486 
        186.08908450 
        186.05171808 
   
  
  
       4.47    4.47
       4.54    4.55
   
        186.79510349 
        186.84246781 
        186.81089159 
   
  
  
       4.63    4.64
       4.70    4.71
   
        186.85240781 
        186.88481394 
        186.86320985 
   
  
  
       4.54    4.54
       4.61    4.62
   
        187.29559988 
        187.31651657 
        187.30257211 
   
  
  
       4.21    4.21
       4.29    4.29
   
        187.26482895 
        187.26941199 
        187.26635663 
   
  
  
       4.58    4.58
       4.66    4.66
   
        187.19703719 
        187.24167764 
        187.21191734 
   
  
  
       4.04    4.05
       4.11    4.13
   
        187.31063530 
        187.37115639 
        187.33080900 
   
  
  
       4.18    4.19
       4.26    4.26
   
        187.32334439 
        187.37744585 
        187.34137821 
   
  
  
       4.54    4.55
       4.62    4.62
   
        187.29842399 
        187.30674056 
        187.30119618 
   
  
  
       4.15    4.16
       4.23    4.23
   
        187.31829402 
        187.36050654 
        187.33236486 
   
  
  
       4.29    4.31
       4.37    4.38
   
        187.31170396 
        187.36673393 
        187.33004729 
   
  
  
       4.21    4.21
       4.29    4.29
   
        187.31329295 
        187.35853268 
        187.32837286 
   
  
  
       3.78    3.80
       3.85    3.87
   
        187.31145837 
        187.36247454 
        187.32846376 
   
  
  
       3.70    3.71
       3.77    3.78
   
        187.31182249 
        187.35696091 
        187.32686863 
   
  
  
       3.47    3.47
       3.54    3.55
   
        187.31149370 
        187.35592231 
        187.32630324 
   
  
  
       3.03    3.04
       3.11    3.11
   
        187.31138832 
        187.35780540 
        187.32686068 
   
  
  
       2.88    2.88
       2.95    2.96
   
        187.31134049 
        187.35735254 
        187.32667784 
   
  
  
       2.51    2.53
       2.58    2.61
   
        187.31130729 
        187.35684575 
        187.32648677 
   
  
  
       2.27    2.29
       2.37    2.50
   
        187.31128087 
        187.35649636 
        187.32635270