vasp 
  6.2.1  
  16May21 (build Apr 11 2022 11:03:26) complex                          parallel 
  Lin64 
  2024 08 31 
  12:34:34 
 
 
  No title
       0
  Normal
  Normal (blocked Davidson)
   F  
       2
       2
       1
     200
       2
      -1
        0.00001000
       -0.02000000
       0
       2
       1
      400.00000000
        1.11000000      0.32000000      0.73000000
  Auto
       1
        0.20000000
       1
   F  
   F  
       1
 
 
  
   
    
            7.66310000       0.00000000       0.00000000 
            0.00000000      19.66310000       0.00000000 
            0.00000000       0.00000000      10.83726000 
    
       1632.96160543 
    
            0.13049549       0.00000000       0.00000000 
            0.00000000       0.05085668       0.00000000 
            0.00000000       0.00000000       0.09227425 
    
   
   
           0.93083500       0.52798019       0.10803629 
           0.84994651       0.23253252       0.42795085 
           0.13652806       0.44757668       0.19526486 
           0.09272672       0.28233531       0.33281865 
           0.81796616       0.33289066       0.02640256 
           0.95688928       0.42119877       0.51839519 
           0.08149666       0.33317503       0.13689446 
           0.19862952       0.40674649       0.39034256 
           0.83175767       0.54480710       0.52120358 
           0.77140302       0.24365177       0.88261146 
           0.06109311       0.51049612       0.65298164 
           0.01332742       0.20515279       0.76108026 
           0.90200366       0.30990012       0.59272124 
           0.86423954       0.44380826       0.95534710 
           0.13767370       0.32321824       0.73684626 
           0.09818525       0.43439469       0.81926407 
           0.42360370       0.45973295       0.12156320 
           0.36300856       0.29224491       0.42109609 
           0.69029958       0.48412030       0.20907026 
           0.64289431       0.31346224       0.34135949 
           0.32444266       0.31663258       0.00978555 
           0.43485151       0.43824431       0.52109270 
           0.56122906       0.34627177       0.14099969 
           0.69262250       0.42853370       0.40032857 
           0.31943820       0.55574360       0.55143789 
           0.27377557       0.23095978       0.86428957 
           0.59962391       0.51639733       0.65549571 
           0.53800378       0.20895783       0.75141013 
           0.39652553       0.32860610       0.62405620 
           0.36802342       0.42575376       0.91981124 
           0.66993522       0.32581180       0.72735296 
           0.63071953       0.43594386       0.81513954 
           0.65353552       0.70452122       0.62319655 
           0.67087208       0.71709919       0.56046861 
           0.45735442       0.57977018       0.67577726 
   
  
  
           1 
           2 
           3 
           4 
           5 
           6 
           7 
           8 
           9 
          10 
          11 
          12 
          13 
          14 
          15 
          16 
          17 
          18 
          19 
          20 
          21 
          22 
          23 
          24 
          25 
          26 
          27 
          28 
          29 
          30 
          31 
          32 
          33 
          34 
          35 
  
 
 
  
          2        1        2 
         0.00000000       0.00000000       0.00000000 
         0.50000000       0.00000000       0.00000000 
         0.00000000       1.00000000       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       0.00000000       0.50000000 
          0.50000000       0.00000000       0.50000000 
  
  
          0.25000000 
          0.25000000 
          0.25000000 
          0.25000000 
  
 
 
  
   No title
    F  
  
  
   normal
       400.00000000
       605.39200000
         0.00001000
       38
       10
      105
       -1
       -1
       136.00000000
        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
   
   
         2
     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      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
           0.00000002
           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
   
  
  
       40
       96
       54
       80
      192
      108
    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      0.32000000      0.73000000
      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      1.00000000     16.00000000
         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
        27.99362752
         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  
  
 
 
        35 
         3 
  
   ion
   element
   atomtype
   
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    H    2
    H    2
    O    3
   
  
  
   type
   atomspertype
   element
   mass
   valence
   pseudopotential
   
      32Si     28.08500000      4.00000000  PAW_PBE Si 05Jan2001                  
       2H       1.00000000      1.00000000  PAW_PBE H 15Jun2001                   
       1O      16.00000000      6.00000000  PAW_PBE O 08Apr2002                   
   
  
 
 
  
   
           7.66310000       0.00000000       0.00000000 
           0.00000000      19.66310000       0.00000000 
           0.00000000       0.00000000      10.83726000 
   
      1632.96160543 
   
           0.13049549       0.00000000       0.00000000 
           0.00000000       0.05085668       0.00000000 
           0.00000000       0.00000000       0.09227425 
   
  
  
          0.93083500       0.52798019       0.10803629 
          0.84994651       0.23253252       0.42795085 
          0.13652806       0.44757668       0.19526486 
          0.09272672       0.28233531       0.33281865 
          0.81796616       0.33289066       0.02640256 
          0.95688928       0.42119877       0.51839519 
          0.08149666       0.33317503       0.13689446 
          0.19862952       0.40674649       0.39034256 
          0.83175767       0.54480710       0.52120358 
          0.77140302       0.24365177       0.88261146 
          0.06109311       0.51049612       0.65298164 
          0.01332742       0.20515279       0.76108026 
          0.90200366       0.30990012       0.59272124 
          0.86423954       0.44380826       0.95534710 
          0.13767370       0.32321824       0.73684626 
          0.09818525       0.43439469       0.81926407 
          0.42360370       0.45973295       0.12156320 
          0.36300856       0.29224491       0.42109609 
          0.69029958       0.48412030       0.20907026 
          0.64289431       0.31346224       0.34135949 
          0.32444266       0.31663258       0.00978555 
          0.43485151       0.43824431       0.52109270 
          0.56122906       0.34627177       0.14099969 
          0.69262250       0.42853370       0.40032857 
          0.31943820       0.55574360       0.55143789 
          0.27377557       0.23095978       0.86428957 
          0.59962391       0.51639733       0.65549571 
          0.53800378       0.20895783       0.75141013 
          0.39652553       0.32860610       0.62405620 
          0.36802342       0.42575376       0.91981124 
          0.66993522       0.32581180       0.72735296 
          0.63071953       0.43594386       0.81513954 
          0.65353552       0.70452122       0.62319655 
          0.67087208       0.71709919       0.56046861 
          0.45735442       0.57977018       0.67577726 
  
 
 
  
      12.41   12.42
      14.11   14.13
   
         24.76344702 
       8976.16805551 
     -12257.83210592 
       -264.18751533 
       3167.08814863 
      -2605.71786812 
         -0.00384573 
       -197.06717003 
       3755.32434067 
        598.53548671 
        598.53933244 
        598.53676862 
   
  
  
      15.46   15.48
      15.46   15.48
   
        -89.05497241 
        -89.05143440 
        -89.05379307 
   
  
  
      14.70   14.71
      14.70   14.71
   
       -162.43586988 
       -162.41369410 
       -162.42847795 
   
  
  
      15.31   15.33
      15.32   15.33
   
       -165.47387567 
       -165.44981382 
       -165.46585505 
   
  
  
      16.10   16.15
      16.28   16.33
   
       -165.62534713 
       -165.60126512 
       -165.61731979 
   
  
  
      15.20   15.27
      16.77   16.84
   
     -16177.15049796 
     -16177.14909624 
     -16177.15003072 
   
  
  
      12.88   12.92
      14.20   14.25
   
       -105.31979257 
       -105.31362368 
       -105.31773627 
   
  
  
      16.00   16.04
      17.45   17.49
   
       -141.12759913 
       -141.10896644 
       -141.12138824