vasp 
  6.2.1  
  16May21 (build Apr 11 2022 11:03:26) complex                          parallel 
  Lin64 
  2024 08 22 
  21:05:15 
 
 
  No title
       0
  Normal
  Normal (blocked Davidson)
   F  
       1
       2
       1
      95
       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
 
 
  
   
    
           20.00000000       0.00000000       0.00000000 
            0.00000000      15.00000000       0.00000000 
            0.00000000       0.00000000      15.00000000 
    
       4500.00000000 
    
            0.05000000       0.00000000       0.00000000 
            0.00000000       0.06666667       0.00000000 
            0.00000000       0.00000000       0.06666667 
    
   
   
           0.38198276       0.47407654       0.46956992 
           0.45908746       0.50011675       0.50321328 
           0.35612795       0.37404586       0.50362596 
           0.52802639       0.50452971       0.49523109 
           0.30375173       0.54409527       0.50500999 
           0.37325287       0.32386408       0.58068598 
           0.37588120       0.46679610       0.34455013 
           0.54696855       0.45180025       0.53729565 
           0.54017063       0.49890705       0.42362570 
           0.70326684       0.53111301       0.45571070 
           0.25916064       0.50997005       0.47465959 
           0.29044383       0.54641867       0.57662954 
           0.30103787       0.61278077       0.47839267 
           0.37757592       0.25317069       0.56113446 
           0.42153129       0.34727136       0.60817635 
           0.33320656       0.32704843       0.63188286 
           0.37752710       0.53463462       0.31684162 
           0.41665027       0.42526706       0.31853659 
           0.32672195       0.43619556       0.32905186 
           0.55709360       0.56801241       0.52140472 
   
  
  
           1 
           2 
           3 
           4 
           5 
           6 
           7 
           8 
           9 
          10 
          11 
          12 
          13 
          14 
          15 
          16 
          17 
          18 
          19 
          20 
  
 
 
  
          1        1        1 
         0.00000000       0.00000000       0.00000000 
         1.00000000       0.00000000       0.00000000 
         0.00000000       1.00000000       0.00000000 
         0.00000000       0.00000000       1.00000000 
         0.00000000       0.00000000       0.00000000 
  
  
          0.00000000       0.00000000       0.00000000 
  
  
          1.00000000 
  
 
 
  
   No title
    F  
  
  
   normal
       400.00000000
       644.87300000
         0.00001000
       38
       10
       34
       -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
     F  
          0.00000000      0.00000000      1.00000000
     F  
          0.00000000      0.00000000      0.00000000
     F  
   
   
     F  
     F  
   
   
        95
        -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
   
  
  
       98
       80
       80
      196
      160
      160
    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
  
  
        2
        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
       135.00000000
         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
       95
        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  
  
 
 
        20 
         4 
  
   ion
   element
   atomtype
   
    Si   1
    O    2
    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
   
  
  
   type
   atomspertype
   element
   mass
   valence
   pseudopotential
   
       1Si     28.08500000      4.00000000  PAW_PBE Si 05Jan2001                  
       2O      16.00000000      6.00000000  PAW_PBE O 08Apr2002                   
       4C      12.01100000      4.00000000  PAW_PBE C 08Apr2002                   
      13H       1.00000000      1.00000000  PAW_PBE H 15Jun2001                   
   
  
 
 
  
   
          20.00000000       0.00000000       0.00000000 
           0.00000000      15.00000000       0.00000000 
           0.00000000       0.00000000      15.00000000 
   
      4500.00000000 
   
           0.05000000       0.00000000       0.00000000 
           0.00000000       0.06666667       0.00000000 
           0.00000000       0.00000000       0.06666667 
   
  
  
          0.38198276       0.47407654       0.46956992 
          0.45908746       0.50011675       0.50321328 
          0.35612795       0.37404586       0.50362596 
          0.52802639       0.50452971       0.49523109 
          0.30375173       0.54409527       0.50500999 
          0.37325287       0.32386408       0.58068598 
          0.37588120       0.46679610       0.34455013 
          0.54696855       0.45180025       0.53729565 
          0.54017063       0.49890705       0.42362570 
          0.70326684       0.53111301       0.45571070 
          0.25916064       0.50997005       0.47465959 
          0.29044383       0.54641867       0.57662954 
          0.30103787       0.61278077       0.47839267 
          0.37757592       0.25317069       0.56113446 
          0.42153129       0.34727136       0.60817635 
          0.33320656       0.32704843       0.63188286 
          0.37752710       0.53463462       0.31684162 
          0.41665027       0.42526706       0.31853659 
          0.32672195       0.43619556       0.32905186 
          0.55709360       0.56801241       0.52140472 
  
  
     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 
     T  T  T 
     T  T  T 
     T  T  T 
     T  T  T 
     T  T  T 
     T  T  T 
     T  T  T 
     T  T  T 
  
  
         -3.00000000       0.00000000       0.00010000       0.00010000 
  
 
 
  
       0.87    0.93
       2.45    2.51
   
          1.68550828 
       2556.94865285 
      -3789.58147999 
        127.83058122 
       1243.05329558 
      -1231.45038952 
          0.01556718 
       -256.39449130 
       1718.32325843 
        370.43050274 
        370.41493556 
        370.42531368 
   
  
  
       1.03    1.04
       1.03    1.04
   
         84.81333251 
         84.85141276 
         84.82602593 
   
  
  
       0.95    0.95
       0.95    0.95
   
        -85.49824539 
        -85.44182643 
        -85.47943907 
   
  
  
       0.87    0.87
       0.87    0.87
   
       -111.85573277 
       -111.79931381 
       -111.83692645 
   
  
  
       0.89    0.89
       1.09    1.09
   
       -112.64399734 
       -112.58757838 
       -112.62519102 
   
  
  
       0.75    0.76
       2.37    2.38
   
       -102.46272887 
       -102.40630991 
       -102.44392255 
   
  
  
       0.66    0.69
       2.24    2.28
   
       -101.04650222 
       -100.99008901 
       -101.02769782 
   
  
  
       0.63    0.66
       2.25    2.28
   
       -100.59765277 
       -100.56424473 
       -100.58651676 
   
  
  
       0.85    0.90
       2.52    2.58
   
       -100.95888680 
       -100.90579958 
       -100.94119106 
   
  
  
       0.60    0.61
       2.49    2.50
   
       -100.54595947 
       -100.47192630 
       -100.52128175 
   
  
  
       0.66    0.67
       2.23    2.24
   
       -100.48641790 
       -100.44614404 
       -100.47299328 
   
  
  
       0.62    0.63
       2.28    2.29
   
       -100.52378468 
       -100.48553636 
       -100.51103524 
   
  
  
       0.58    0.64
       2.17    2.22
   
       -100.53164979 
       -100.47918564 
       -100.51416174 
   
  
  
       0.53    0.57
       2.05    2.10
   
       -100.53321971 
       -100.48168456 
       -100.51604132 
   
  
  
       0.54    0.55
       2.15    2.15
   
       -100.52362024 
       -100.48741573 
       -100.51155207 
   
  
  
       0.54    0.55
       2.07    2.08
   
       -100.51484144 
       -100.48291105 
       -100.50419797 
   
  
  
       0.52    0.54
       2.09    2.11
   
       -100.51038904 
       -100.45048277 
       -100.49042029 
   
  
  
       0.50    0.52
       2.09    2.14
   
       -100.51590880 
       -100.44598002 
       -100.49259921 
   
  
  
       0.48    0.51
       2.05    2.08
   
       -100.51595335 
       -100.44700600 
       -100.49297090 
   
  
  
       0.52    0.55
       2.17    2.20
   
       -100.51820480 
       -100.45022255 
       -100.49554405 
   
  
  
       0.48    0.49
       2.13    2.14
   
       -100.51757745 
       -100.45745042 
       -100.49753510 
   
  
  
       0.56    0.60
       2.24    2.27
   
       -100.51939435 
       -100.46682451 
       -100.50187107 
   
  
  
       0.50    0.52
       2.42    2.45
   
       -100.52039713 
       -100.46859073 
       -100.50312833 
   
  
  
       0.59    0.59
       2.44    2.45
   
       -100.52080069 
       -100.46606989 
       -100.50255709 
   
  
  
       0.62    0.64
       2.42    2.46
   
       -100.52095454 
       -100.46547651 
       -100.50246186 
   
  
  
       0.39    0.44
       1.86    1.92
   
       -100.52103734 
       -100.46557386 
       -100.50254951 
   
  
  
       0.23    0.23
       1.58    1.59
   
       -100.52109456 
       -100.46513795 
       -100.50244236 
   
  
  
       0.42    0.44
       2.00    2.02
   
       -100.52197929 
       -100.46652112 
       -100.50349323 
   
  
  
       0.39    0.41
       1.47    1.49
   
       -100.52302549 
       -100.46756704 
       -100.50453934 
   
  
  
       0.21    0.22
       1.22    1.23
   
       -100.52303271 
       -100.46759538 
       -100.50455360 
   
  
  
       0.17    0.17
       0.83    0.83
   
       -100.52304279 
       -100.46758326 
       -100.50455628 
   
  
  
       0.16    0.16
       0.71    0.72
   
       -100.52315648 
       -100.46773282 
       -100.50468193 
   
  
  
       0.15    0.15
       0.67    0.67
   
       -100.52315598 
       -100.46773107 
       -100.50468101 
   
  
  
       0.19    0.19
       0.70    0.71
   
       -113.03971973 
       -112.98564677 
       -113.02169541 
   
  
  
       0.15    0.15
       0.66    0.66
   
       -100.43467761 
       -100.37963562 
       -100.41633028 
   
  
  
       0.16    0.16
       0.69    0.69
   
       -100.52691537 
       -100.45089003 
       -100.50157359 
   
  
  
       0.15    0.15
       0.68    0.68
   
       -100.52047834 
       -100.46525794 
       -100.50207154 
   
  
  
       0.17    0.17
       0.68    0.68
   
       -100.52312375 
       -100.46851514 
       -100.50492088 
   
  
  
       0.20    0.20
       0.72    0.72
   
       -100.52549073 
       -100.47066313 
       -100.50721487 
   
  
  
       0.17    0.17
       0.69    0.69
   
       -100.52544448 
       -100.47062100 
       -100.50716999 
   
  
  
       0.19    0.20
       0.72    0.72
   
       -100.52577291 
       -100.47095011 
       -100.50749864 
   
  
  
       0.17    0.17
       0.70    0.70
   
       -100.52577532 
       -100.47115564 
       -100.50756876 
   
  
  
       0.19    0.19
       0.72    0.73
   
       -100.52742064 
       -100.47227525 
       -100.50903884 
   
  
  
       0.18    0.18
       0.72    0.72
   
       -100.52739059 
       -100.47228682 
       -100.50902266 
   
  
  
       0.19    0.19
       0.73    0.73
   
       -100.52824839 
       -100.47348982 
       -100.50999553 
   
  
  
       0.18    0.18
       0.74    0.74
   
       -100.52824158 
       -100.47344792 
       -100.50997703 
   
  
  
       0.21    0.21
       0.77    0.77
   
       -458.36573646 
       -458.34644227 
       -458.35930506 
   
  
  
       0.15    0.15
       0.70    0.71
   
        -91.02652767 
        -90.97118432 
        -91.00807989 
   
  
  
       0.17    0.17
       0.72    0.72
   
       -133.59292279 
       -133.56192009 
       -133.58258856 
   
  
  
       0.21    0.21
       0.76    0.76
   
     -53418.98172920 
     -53418.94273010 
     -53418.96872950 
   
  
  
       0.19    0.19
       0.73    0.73
   
     -64769.82754950 
     -64769.77113056 
     -64769.80874319