vasp 
  6.2.1  
  16May21 (build Apr 11 2022 11:03:26) complex                          parallel 
  Lin64 
  2025 05 17 
  22:59:08 
 
 
  No title
       0
  Normal
  Normal (blocked Davidson)
   F  
       1
       2
       1
     200
       2
      -1
        0.00001000
       -0.02000000
       0
       2
       1
      400.00000000
        1.11000000      0.73000000      0.77000000      0.32000000
  Auto
       1
        0.20000000
       1
   F  
   F  
       1
 
 
  
   
    
           15.00000000       0.00000000       0.00000000 
            0.00000000      10.00000000       0.00000000 
            0.00000000       0.00000000      10.00000000 
    
       1500.00000000 
    
            0.06666667       0.00000000       0.00000000 
            0.00000000       0.10000000       0.00000000 
            0.00000000       0.00000000       0.10000000 
    
   
   
           0.17136573       0.56924710       0.72849710 
           0.37998825       0.59331873       0.67768810 
           0.27841101       0.61711624       0.73048574 
           0.39321224       0.65459295       0.50411586 
           0.46818830       0.64698035       0.79392133 
           0.16355411       0.38277793       0.74346395 
           0.11461717       0.62955004       0.57259244 
           0.12822546       0.63305787       0.84712586 
           0.46127571       0.64521057       0.46507079 
           0.37593600       0.76048982       0.50929388 
           0.34796676       0.60780769       0.43159919 
           0.50320796       0.74664947       0.77839904 
           0.46107252       0.62821618       0.90019419 
           0.09339216       0.35003082       0.74683825 
           0.19616274       0.34679085       0.83514274 
           0.19519133       0.33263104       0.65773126 
           0.14442582       0.58535795       0.48224760 
           0.11866980       0.73895124       0.56336613 
           0.04338049       0.60221212       0.57332468 
           0.35173405       0.89410783       0.89205960 
           0.50992021       0.53154519       0.73344498 
           0.43110089       0.45906996       0.67289434 
   
  
  
           1 
           2 
           3 
           4 
           5 
           6 
           7 
           8 
           9 
          10 
          11 
          12 
          13 
          14 
          15 
          16 
          17 
          18 
          19 
          20 
          21 
          22 
  
 
 
  
          1        2        2 
         0.00000000       0.00000000       0.00000000 
         1.00000000       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 
          0.00000000       0.50000000       0.00000000 
          0.00000000       0.00000000       0.50000000 
          0.00000000       0.50000000       0.50000000 
  
  
          0.25000000 
          0.25000000 
          0.25000000 
          0.25000000 
  
 
 
  
   No title
    F  
  
  
   normal
       400.00000000
       644.87300000
         0.00001000
       38
       10
       36
       -1
       -1
        45.00000000
        0
        0
        0
        0
         0.00000000
   
         1
          0.20000000
          0.50000000
     T  
     T  
   
   
     T  
         -0.00050000     -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      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
           0.00000007
           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
   
  
  
       80
       50
       50
      160
      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
         1.11000000      0.73000000      0.77000000      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
  
  
        3
        4
       -1
    T  
    F  
    F  
    F  
    F  
    F  
  
  
        3
       -1
    F  
        28.08500000     16.00000000     12.01100000      1.00000000
         0.00000000      0.00000000      0.00000000      0.00000000
         1.00000000      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
        40.90909091
         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  
  
 
 
        22 
         4 
  
   ion
   element
   atomtype
   
    Si   1
    Si   1
    O    2
    C    3
    C    3
    C    3
    C    3
    H    4
    H    4
    H    4
    H    4
    H    4
    H    4
    H    4
    H    4
    H    4
    H    4
    H    4
    H    4
    H    4
    H    4
    H    4
   
  
  
   type
   atomspertype
   element
   mass
   valence
   pseudopotential
   
       2Si     28.08500000      4.00000000  PAW_PBE Si 05Jan2001                  
       1O      16.00000000      6.00000000  PAW_PBE O 08Apr2002                   
       4C      12.01100000      4.00000000  PAW_PBE C 08Apr2002                   
      15H       1.00000000      1.00000000  PAW_PBE H 15Jun2001                   
   
  
 
 
  
   
          15.00000000       0.00000000       0.00000000 
           0.00000000      10.00000000       0.00000000 
           0.00000000       0.00000000      10.00000000 
   
      1500.00000000 
   
           0.06666667       0.00000000       0.00000000 
           0.00000000       0.10000000       0.00000000 
           0.00000000       0.00000000       0.10000000 
   
  
  
          0.17136573       0.56924710       0.72849710 
          0.37998825       0.59331873       0.67768810 
          0.27841101       0.61711624       0.73048574 
          0.39321224       0.65459295       0.50411586 
          0.46818830       0.64698035       0.79392133 
          0.16355411       0.38277793       0.74346395 
          0.11461717       0.62955004       0.57259244 
          0.12822546       0.63305787       0.84712586 
          0.46127571       0.64521057       0.46507079 
          0.37593600       0.76048982       0.50929388 
          0.34796676       0.60780769       0.43159919 
          0.50320796       0.74664947       0.77839904 
          0.46107252       0.62821618       0.90019419 
          0.09339216       0.35003082       0.74683825 
          0.19616274       0.34679085       0.83514274 
          0.19519133       0.33263104       0.65773126 
          0.14442582       0.58535795       0.48224760 
          0.11866980       0.73895124       0.56336613 
          0.04338049       0.60221212       0.57332468 
          0.35173405       0.89410783       0.89205960 
          0.50992021       0.53154519       0.73344498 
          0.43110089       0.45906996       0.67289434 
  
  
     T  T  T 
     T  T  T 
     F  F  F 
     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 
     T  T  T 
     T  T  T 
     T  T  T 
     T  T  T 
     T  T  T 
     T  T  T 
     F  F  F 
     T  T  T 
     T  T  T 
  
  
         -3.00000000       0.00000000       0.00010000       0.00010000 
  
 
 
  
       2.29    2.31
       2.66    2.67
   
          4.76039610 
       1386.73996062 
      -2374.26269361 
         94.99252594 
        988.89567318 
       -957.91857019 
         -0.00415961 
       -291.16782164 
       1414.08307395 
        266.11838473 
        266.12254434 
        266.11977127 
   
  
  
       3.27    3.28
       3.27    3.28
   
        -39.12089871 
        -39.09819668 
        -39.11333137 
   
  
  
       2.70    2.71
       2.70    2.71
   
       -115.49215246 
       -115.43612982 
       -115.47347825 
   
  
  
       2.45    2.46
       2.45    2.47
   
       -120.25852455 
       -120.20210562 
       -120.23971824 
   
  
  
       2.56    2.58
       2.62    2.64
   
       -120.35669943 
       -120.30028048 
       -120.33789312 
   
  
  
       1.15    1.17
       1.73    1.75
   
       -107.96581078 
       -107.90939188 
       -107.94700448 
   
  
  
       2.41    2.43
       2.98    3.00
   
       -106.57472670 
       -106.51830860 
       -106.55592066 
   
  
  
       2.60    2.62
       3.76    3.78
   
       -106.10388601 
       -106.04747522 
       -106.08508241 
   
  
  
       2.60    2.62
       3.36    3.38
   
       -105.98061775 
       -105.92424863 
       -105.96182804 
   
  
  
       2.48    2.50
       3.16    3.18
   
       -105.96995631 
       -105.91354477 
       -105.95115246 
   
  
  
       2.34    2.35
       2.77    2.78
   
       -105.96572452 
       -105.90932400 
       -105.94692435 
   
  
  
       1.99    2.02
       2.44    2.47
   
       -105.96671344 
       -105.91031052 
       -105.94791247 
   
  
  
       2.11    2.16
       2.65    2.70
   
       -105.97080883 
       -105.91440855 
       -105.95200874 
   
  
  
       2.04    2.08
       2.82    2.86
   
       -105.97425783 
       -105.91786257 
       -105.95545941 
   
  
  
       2.27    2.30
       2.73    2.75
   
       -105.97760664 
       -105.92120961 
       -105.95880763