vasp 
  6.2.1  
  16May21 (build Apr 11 2022 11:03:26) complex                          parallel 
  Lin64 
  2024 08 17 
  00:12:44 
 
 
  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 
    
   
   
           0.36872444       0.49284401       0.48651956 
           0.35905562       0.56553944       0.40745243 
           0.44668441       0.49820543       0.51125203 
           0.34131403       0.39301812       0.46296263 
           0.31882257       0.51962256       0.57777778 
           0.29714747       0.58378668       0.36372834 
           0.47769594       0.45432515       0.58557471 
           0.36953105       0.34073044       0.39175373 
           0.31727222       0.59673779       0.61434788 
           0.27663355       0.52374948       0.33132309 
           0.25956170       0.60956458       0.41114134 
           0.30628921       0.63471015       0.31258919 
           0.45937509       0.38544182       0.59357164 
           0.53185440       0.45244037       0.57356155 
           0.46819152       0.49137166       0.64760712 
           0.34359806       0.27625253       0.39106882 
           0.36241163       0.37361635       0.32678440 
           0.42336178       0.32936980       0.40211599 
           0.41462244       0.65653237       0.64390859 
           0.32347655       0.65845359       0.57474313 
           0.28045970       0.60085216       0.67115724 
           0.54629688       0.75044173       0.58167366 
   
  
  
           1 
           2 
           3 
           4 
           5 
           6 
           7 
           8 
           9 
          10 
          11 
          12 
          13 
          14 
          15 
          16 
          17 
          18 
          19 
          20 
          21 
          22 
  
 
 
  
          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
       42
       -1
       -1
        57.00000000
        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  
   
   
        95
        -5
         2
        400.00000000
    
      T  
      F  
           0.00000000
           0.00000006
           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
  
  
        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
       122.72727273
         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  
  
 
 
        22 
         4 
  
   ion
   element
   atomtype
   
    Si   1
    O    2
    O    2
    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                  
       4O      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 
   
  
  
          0.36872444       0.49284401       0.48651956 
          0.35905562       0.56553944       0.40745243 
          0.44668441       0.49820543       0.51125203 
          0.34131403       0.39301812       0.46296263 
          0.31882257       0.51962256       0.57777778 
          0.29714747       0.58378668       0.36372834 
          0.47769594       0.45432515       0.58557471 
          0.36953105       0.34073044       0.39175373 
          0.31727222       0.59673779       0.61434788 
          0.27663355       0.52374948       0.33132309 
          0.25956170       0.60956458       0.41114134 
          0.30628921       0.63471015       0.31258919 
          0.45937509       0.38544182       0.59357164 
          0.53185440       0.45244037       0.57356155 
          0.46819152       0.49137166       0.64760712 
          0.34359806       0.27625253       0.39106882 
          0.36241163       0.37361635       0.32678440 
          0.42336178       0.32936980       0.40211599 
          0.41462244       0.65653237       0.64390859 
          0.32347655       0.65845359       0.57474313 
          0.28045970       0.60085216       0.67115724 
          0.54629688       0.75044173       0.58167366 
  
  
     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 
     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 
  
 
 
  
   
   
   
          2.72167375 
       4010.80243249 
      -5949.26621859 
        183.73774590 
       1936.15224937 
      -1928.14668463 
         -0.02538185 
       -324.57352972 
       2582.84965050 
        514.25193721 
        514.27731907 
        514.26039783 
   
  
  
   
   
   
        130.75454728 
        130.78368290 
        130.76425915 
   
  
  
   
   
   
        -89.83473484 
        -89.77857276 
        -89.81601414 
   
  
  
   
   
   
       -122.03161365 
       -121.97519469 
       -122.01280733 
   
  
  
   
   
   
       -122.86783626 
       -122.81141730 
       -122.84902994 
   
  
  
   
   
   
       -114.26476995 
       -114.20847221 
       -114.24600404 
   
  
  
   
   
   
       -112.85658123 
       -112.80208744 
       -112.83841663 
   
  
  
   
   
   
       -112.49373157 
       -112.43735953 
       -112.47494089 
   
  
  
   
   
   
       -112.40252446 
       -112.34711976 
       -112.38405622 
   
  
  
   
   
   
       -112.38160316 
       -112.32523409 
       -112.36281347 
   
  
  
   
   
   
       -112.37526477 
       -112.31919786 
       -112.35657580 
   
  
  
   
   
   
       -112.37330553 
       -112.31715694 
       -112.35458933 
   
  
  
   
   
   
       -112.37683744 
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       -112.38450748 
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       -112.39207589 
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       -112.39580768 
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       -112.39992766 
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       -112.40319338 
       -112.34708860 
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       -112.40445461 
       -112.34834184 
       -112.38575035 
   
  
  
   
   
   
       -112.40515335 
       -112.34904373 
       -112.38645014