vasp 
  6.2.1  
  16May21 (build Apr 11 2022 11:03:26) complex                          parallel 
  Lin64 
  2024 08 30 
  22:29:43 
 
 
  No title
       0
  Normal
  Normal (blocked Davidson)
   F  
       1
       2
       1
     200
       2
      -1
        0.00001000
       -0.02000000
       0
       2
       1
      400.00000000
        0.73000000      1.11000000      0.32000000      0.75000000
  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 
    
   
   
           0.92636819       0.87927654       0.42563207 
           0.71256453       0.51107437       0.53918414 
           0.02787360       0.39361148       0.98139669 
           0.23827200       0.52417262       0.50588358 
           0.48758455       0.03409085       0.41596929 
           0.29907446       0.87432397       0.32261865 
           0.24189286       0.74920497       0.04015468 
           0.55151752       0.79776557       0.89638360 
           0.05564677       0.02229553       0.21309758 
           0.31618012       0.85486672       0.89499835 
           0.14841528       0.42814344       0.07954461 
           0.73053005       0.24961007       0.52310948 
   
  
  
           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 
          0.00000000       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
       627.11200000
         0.00001000
       38
       10
       20
       -1
       -1
        27.00000000
        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
     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
           0.00000013
           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
         0.73000000      1.11000000      0.32000000      0.75000000
      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
  
  
        2
        4
       -1
    T  
    F  
    F  
    F  
    F  
    F  
  
  
        3
       -1
    F  
        16.00000000     28.08500000      1.00000000     14.00100000
         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
        50.00000000
         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 
         4 
  
   ion
   element
   atomtype
   
    O    1
    Si   2
    Si   2
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    N    4
   
  
  
   type
   atomspertype
   element
   mass
   valence
   pseudopotential
   
       1O      16.00000000      6.00000000  PAW_PBE O 08Apr2002                   
       2Si     28.08500000      4.00000000  PAW_PBE Si 05Jan2001                  
       8H       1.00000000      1.00000000  PAW_PBE H 15Jun2001                   
       1N      14.00100000      5.00000000  PAW_PBE N 08Apr2002                   
   
  
 
 
  
   
          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 
   
  
  
          0.92636819       0.87927654       0.42563207 
          0.71256453       0.51107437       0.53918414 
          0.02787360       0.39361148       0.98139669 
          0.23827200       0.52417262       0.50588358 
          0.48758455       0.03409085       0.41596929 
          0.29907446       0.87432397       0.32261865 
          0.24189286       0.74920497       0.04015468 
          0.55151752       0.79776557       0.89638360 
          0.05564677       0.02229553       0.21309758 
          0.31618012       0.85486672       0.89499835 
          0.14841528       0.42814344       0.07954461 
          0.73053005       0.24961007       0.52310948 
  
  
     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 
  
  
         -3.00000000       0.00000000       0.00010000       0.00010000 
  
 
 
  
       1.29    1.40
       1.42    1.54
   
          2.18778779 
       -291.81255136 
       -546.24092849 
         37.62532379 
        744.80202722 
       -712.67614060 
         -0.01232420 
       -109.67659316 
       1002.69875223 
        126.89535321 
        126.90767741 
        126.89946128 
   
  
  
       3.39    3.41
       3.39    3.41
   
         17.22594481 
         17.20742348 
         17.21977103 
   
  
  
       3.10    3.11
       3.10    3.11
   
        -17.52995236 
        -17.43378627 
        -17.49789700 
   
  
  
       3.40    3.41
       3.40    3.41
   
        -24.11303590 
        -24.04439125 
        -24.09015435 
   
  
  
       2.98    2.99
       3.02    3.02
   
        -24.46122027 
        -24.39168638 
        -24.43804231 
   
  
  
       3.28    3.29
       3.43    3.43
   
        -57.02618335 
        -57.00119243 
        -57.01785304 
   
  
  
       2.67    2.68
       2.84    2.85
   
        -24.19609096 
        -24.18120566 
        -24.19112919 
   
  
  
       3.46    3.46
       3.59    3.59
   
        -19.22794013 
        -19.13360954 
        -19.19649660 
   
  
  
       3.81    3.82
       3.96    3.97
   
        -17.85624878 
        -17.83038366 
        -17.84762707 
   
  
  
       3.52    3.52
       3.71    3.72
   
        -16.56026795 
        -16.54434246 
        -16.55495945 
   
  
  
       3.25    3.26
       3.38    3.39
   
        -16.81979740 
        -16.82922310 
        -16.82293930 
   
  
  
       3.41    3.42
       3.58    3.59
   
        -20.77471748 
        -20.72987773 
        -20.75977089 
   
  
  
       3.42    3.43
       3.56    3.57
   
        -21.80183564 
        -21.76028066 
        -21.78798398 
   
  
  
       3.41    3.42
       3.55    3.56
   
        -18.27283108 
        -18.29571117 
        -18.28045778 
   
  
  
       3.36    3.36
       3.49    3.50
   
        -17.65802311 
        -17.47499589 
        -17.59701404 
   
  
  
       3.81    3.81
       3.94    3.95
   
        -17.33751775 
        -17.17697011 
        -17.28400187 
   
  
  
       3.73    3.74
       3.87    3.88
   
        -17.26098744 
        -17.21593666 
        -17.24597051