vasp 
  6.2.1  
  16May21 (build Apr 11 2022 11:03:26) complex                          parallel 
  Lin64 
  2024 08 31 
  03:29:13 
 
 
  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 
    
   
   
           0.92368581       0.52758226       0.10498411 
           0.85547811       0.23437617       0.42972878 
           0.13449759       0.44988781       0.19580011 
           0.09682600       0.28691235       0.33648128 
           0.82292117       0.33172325       0.02726117 
           0.95676507       0.42180759       0.51758471 
           0.08506405       0.33478733       0.13830070 
           0.19821955       0.40579846       0.38887933 
           0.83175406       0.54657815       0.52577018 
           0.77493748       0.24411298       0.88140948 
           0.06041224       0.50973732       0.65369129 
           0.01989462       0.20677620       0.76130761 
           0.90404257       0.31133177       0.59556478 
           0.86484814       0.44222554       0.95306692 
           0.14390062       0.32452125       0.73655235 
           0.10119717       0.43459270       0.82020501 
           0.41703554       0.46990933       0.12006377 
           0.37083217       0.28174519       0.42388222 
           0.68852312       0.47755006       0.20515608 
           0.64482727       0.31503353       0.34586547 
           0.32995114       0.32047456       0.01364441 
           0.43479993       0.43650750       0.51997832 
           0.56929980       0.35074375       0.14458439 
           0.69286252       0.42945991       0.40247702 
           0.31470547       0.55120469       0.54361267 
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           0.59680401       0.52019455       0.65654060 
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           0.62759108       0.43817457       0.81438825 
           0.65091279       0.69321555       0.62717388 
           0.64339300       0.70105460       0.56163582 
           0.44978528       0.58369278       0.65317676 
   
  
  
           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 
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          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
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         0.50000000
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         0.00010000
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        1
        1
      256
        16.00000000
  
  
        2
         0.00001000
  
  
        0
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      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
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    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
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    F  
         0.00000000      0.00000000      0.00000000
    T  
    F  
    F  
    F  
    T  
        0
         0.00000000      0.00000000      0.00000000
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    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 
   
  
  
          0.92368581       0.52758226       0.10498411 
          0.85547811       0.23437617       0.42972878 
          0.13449759       0.44988781       0.19580011 
          0.09682600       0.28691235       0.33648128 
          0.82292117       0.33172325       0.02726117 
          0.95676507       0.42180759       0.51758471 
          0.08506405       0.33478733       0.13830070 
          0.19821955       0.40579846       0.38887933 
          0.83175406       0.54657815       0.52577018 
          0.77493748       0.24411298       0.88140948 
          0.06041224       0.50973732       0.65369129 
          0.01989462       0.20677620       0.76130761 
          0.90404257       0.31133177       0.59556478 
          0.86484814       0.44222554       0.95306692 
          0.14390062       0.32452125       0.73655235 
          0.10119717       0.43459270       0.82020501 
          0.41703554       0.46990933       0.12006377 
          0.37083217       0.28174519       0.42388222 
          0.68852312       0.47755006       0.20515608 
          0.64482727       0.31503353       0.34586547 
          0.32995114       0.32047456       0.01364441 
          0.43479993       0.43650750       0.51997832 
          0.56929980       0.35074375       0.14458439 
          0.69286252       0.42945991       0.40247702 
          0.31470547       0.55120469       0.54361267 
          0.27678417       0.23421924       0.86828263 
          0.59680401       0.52019455       0.65654060 
          0.53841073       0.20907597       0.75561540 
          0.39862158       0.32859545       0.62012481 
          0.36848938       0.42846273       0.92218897 
          0.66738704       0.32660703       0.72691290 
          0.62759108       0.43817457       0.81438825 
          0.65091279       0.69321555       0.62717388 
          0.64339300       0.70105460       0.56163582 
          0.44978528       0.58369278       0.65317676 
  
 
 
  
      12.34   12.36
      13.20   13.22
   
         24.76344702 
       9021.04702431 
     -12299.88791360 
       -263.99305948 
       3167.08814863 
      -2605.71786812 
         -0.00487325 
       -197.84956587 
       3755.32434067 
        600.76968032 
        600.77455357 
        600.77130474 
   
  
  
      15.59   15.62
      15.59   15.62
   
        -88.57144005 
        -88.56837749 
        -88.57041919 
   
  
  
      14.71   14.78
      14.71   14.79
   
       -162.23031447 
       -162.21170680 
       -162.22411191 
   
  
  
      15.34   15.38
      15.34   15.39
   
       -165.29222850 
       -165.27266886 
       -165.28570862 
   
  
  
      15.92   15.96
      16.11   16.15
   
       -165.44305235 
       -165.42346773 
       -165.43652414 
   
  
  
      14.02   14.07
      15.10   15.14
   
      -1854.72804077 
      -1854.72965306 
      -1854.72857820 
   
  
  
      14.31   14.35
      15.17   15.21
   
       -100.77362131 
       -100.78453844 
       -100.77726035 
   
  
  
      15.03   15.06
      15.89   15.91
   
      -1707.64597447 
      -1707.62877579 
      -1707.64024158 
   
  
  
      13.95   14.00
      14.85   14.90
   
       -137.24563841 
       -137.23216325 
       -137.24114669 
   
  
  
      14.90   14.95
      15.76   15.81
   
       -145.39168576 
       -145.37708269 
       -145.38681807 
   
  
  
      15.16   15.20
      16.03   16.08
   
       -146.09181800 
       -146.07255837 
       -146.08539812 
   
  
  
      14.53   14.60
      15.50   15.56
   
       -149.82675736 
       -149.80446042 
       -149.81932505 
   
  
  
      13.75   13.78
      14.66   14.70
   
       -153.01779301 
       -153.00076112 
       -153.01211571 
   
  
  
      12.02   12.05
      12.92   12.96
   
       -156.79114736 
       -156.79018517 
       -156.79082663 
   
  
  
      13.93   13.97
      14.81   14.85
   
       -166.53701784 
       -166.53917337 
       -166.53773635 
   
  
  
      17.45   17.49
      18.33   18.37
   
       -167.80143586 
       -167.80413218 
       -167.80233463 
   
  
  
      12.72   12.76
      13.67   13.71
   
       -155.36906067 
       -155.36784254 
       -155.36865463 
   
  
  
      12.79   12.83
      13.79   13.82
   
       -154.95459358 
       -154.95122325 
       -154.95347014 
   
  
  
      12.95   13.01
      13.88   13.93
   
       -160.40956828 
       -160.41839177 
       -160.41250944 
   
  
  
      13.27   13.33
      14.20   14.26
   
       -166.30720806 
       -166.34038835 
       -166.31826815 
   
  
  
      13.96   14.01
      14.94   14.99
   
       -168.93402046 
       -168.96384717 
       -168.94396270 
   
  
  
      13.60   13.65
      14.66   14.71
   
       -169.66269453 
       -169.68996949 
       -169.67178618 
   
  
  
      13.30   13.36
      14.23   14.29
   
       -169.05287646 
       -169.07935183 
       -169.06170158 
   
  
  
      13.94   13.99
      14.86   14.90
   
       -169.84031403 
       -169.86657258 
       -169.84906688 
   
  
  
      13.79   13.83
      15.09   15.13
   
       -173.15441866 
       -173.18036364 
       -173.16306699 
   
  
  
      20.01   20.06
      21.16   21.22
   
     -14257.18209648 
     -14257.18100408 
     -14257.18173235 
   
  
  
      12.58   12.62
      13.50   13.54
   
      -1639.74595753 
      -1639.73246126 
      -1639.74145877 
   
  
  
      14.44   14.48
      15.39   15.44
   
       -159.66935711 
       -159.68998074 
       -159.67623165 
   
  
  
      13.27   13.32
      14.26   14.31
   
       -169.80448874 
       -169.82924084 
       -169.81273944 
   
  
  
      12.15   12.19
      13.10   13.14
   
       -171.35796734 
       -171.38344796 
       -171.36646088 
   
  
  
      11.01   11.07
      12.18   12.24
   
       -168.80157098 
       -168.82734427 
       -168.81016208 
   
  
  
      11.61   11.65
      12.65   12.68
   
       -177.46511631 
       -177.49091690 
       -177.47371651 
   
  
  
       5.27    5.31
       6.28    6.32
   
       -167.65567768 
       -167.68145838 
       -167.66427124 
   
  
  
       3.11    3.17
       4.84    4.90
   
       -170.54513766 
       -170.57089243 
       -170.55372259 
   
  
  
       4.13    4.19
       5.75    5.81
   
      -2810.15567869 
      -2810.13188461 
      -2810.14774733 
   
  
  
       2.62    2.65
       3.84    3.87
   
       -162.93069485 
       -162.95549491 
       -162.93896154 
   
  
  
       1.82    1.85
       2.68    2.71
   
       -165.71966279 
       -165.75149005 
       -165.73027187 
   
  
  
       1.75    1.77
       2.44    2.46
   
       -171.40223721 
       -171.42766066 
       -171.41071169