vasp 
  6.2.1  
  16May21 (build Apr 11 2022 11:03:26) complex                          parallel 
  Lin64 
  2024 09 01 
  14:58:17 
 
 
  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      0.73000000      0.32000000
  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 
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            0.00000000       0.00000000       0.09227425 
    
   
   
           0.93346764       0.53637894       0.07259497 
           0.85114439       0.30921874       0.39072403 
           0.12964747       0.45676997       0.16981002 
           0.14271541       0.31096845       0.32486048 
           0.81638772       0.32720547       0.02944646 
           0.94755024       0.45659562       0.51257265 
           0.09454822       0.33896355       0.11751087 
           0.17215614       0.42749403       0.37498507 
           0.89623364       0.57556380       0.56509175 
           0.77359706       0.25275775       0.85792129 
           0.11858230       0.52207639       0.67512191 
           0.01067876       0.22474329       0.72322671 
           0.91166594       0.34262144       0.59145561 
           0.85890733       0.43712465       0.95029445 
           0.16933903       0.33692479       0.71315091 
           0.11384511       0.43798556       0.82583131 
           0.43222387       0.45227073       0.12209105 
           0.33726577       0.23866812       0.44462958 
           0.71163359       0.48464202       0.18125790 
           0.56694005       0.28527301       0.33564006 
           0.33074735       0.31441200       0.98756488 
           0.44528874       0.43950176       0.47133641 
           0.54784775       0.33629583       0.13843355 
           0.72255463       0.42373063       0.36887126 
           0.40516875       0.53851299       0.59247932 
           0.27944916       0.23663948       0.82707347 
           0.66483884       0.54661807       0.70651336 
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           0.63799150       0.44012158       0.80350892 
           0.38530510       0.60935134       0.50577032 
           0.65031752       0.60589627       0.81560925 
           0.38271877       0.64993276       0.56131738 
           0.74467213       0.60766112       0.87680114 
   
  
  
           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 
          36 
  
 
 
  
          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
      108
       -1
       -1
       142.00000000
        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
         -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
         0.50000000
        -3.00000000
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         0.00010000
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        1
        1
      256
        16.00000000
  
  
        2
         0.00001000
  
  
        0
         1.11000000      0.73000000      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      1.00000000
         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
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        1
        1
        1
    F  
    F  
    F  
        0
        0
    F  
         0.00000000
         0.00000000
        0
  
  
    F  
        -0.84910000
         0.12340000
         1.00000000
         0.00000000
  
  
        0
        27.21602676
         1.00000000
  
  
    F  
    F  
    F  
    F  
        0
         0.10000000
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        -0.10000000
         0.00000000
         0.00000000      0.00000000      0.00000000
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    F  
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    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
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        0
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    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  
  
 
 
        36 
         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
    O    2
    O    2
    H    3
    H    3
   
  
  
   type
   atomspertype
   element
   mass
   valence
   pseudopotential
   
      32Si     28.08500000      4.00000000  PAW_PBE Si 05Jan2001                  
       2O      16.00000000      6.00000000  PAW_PBE O 08Apr2002                   
       2H       1.00000000      1.00000000  PAW_PBE H 15Jun2001                   
   
  
 
 
  
   
           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 
   
  
  
          0.93346764       0.53637894       0.07259497 
          0.85114439       0.30921874       0.39072403 
          0.12964747       0.45676997       0.16981002 
          0.14271541       0.31096845       0.32486048 
          0.81638772       0.32720547       0.02944646 
          0.94755024       0.45659562       0.51257265 
          0.09454822       0.33896355       0.11751087 
          0.17215614       0.42749403       0.37498507 
          0.89623364       0.57556380       0.56509175 
          0.77359706       0.25275775       0.85792129 
          0.11858230       0.52207639       0.67512191 
          0.01067876       0.22474329       0.72322671 
          0.91166594       0.34262144       0.59145561 
          0.85890733       0.43712465       0.95029445 
          0.16933903       0.33692479       0.71315091 
          0.11384511       0.43798556       0.82583131 
          0.43222387       0.45227073       0.12209105 
          0.33726577       0.23866812       0.44462958 
          0.71163359       0.48464202       0.18125790 
          0.56694005       0.28527301       0.33564006 
          0.33074735       0.31441200       0.98756488 
          0.44528874       0.43950176       0.47133641 
          0.54784775       0.33629583       0.13843355 
          0.72255463       0.42373063       0.36887126 
          0.40516875       0.53851299       0.59247932 
          0.27944916       0.23663948       0.82707347 
          0.66483884       0.54661807       0.70651336 
          0.55164017       0.21474920       0.72191511 
          0.40777368       0.33460151       0.57585205 
          0.38524417       0.42654729       0.91645885 
          0.66097551       0.33472788       0.70564806 
          0.63799150       0.44012158       0.80350892 
          0.38530510       0.60935134       0.50577032 
          0.65031752       0.60589627       0.81560925 
          0.38271877       0.64993276       0.56131738 
          0.74467213       0.60766112       0.87680114 
  
 
 
  
      10.20   10.21
      12.23   12.25
   
         27.86983208 
       9158.11395913 
     -12824.54363440 
       -235.83718693 
       3513.49417245 
      -2953.91778466 
          0.00709896 
       -211.21612778 
       4187.58753671 
        661.55786558 
        661.55076662 
        661.55549926 
   
  
  
      12.74   12.75
      12.74   12.75
   
        -88.47684014 
        -88.46901473 
        -88.47423167 
   
  
  
      12.37   12.39
      12.37   12.39
   
       -175.94603604 
       -175.93580316 
       -175.94262508 
   
  
  
      12.59   12.62
      12.59   12.62
   
       -178.98750332 
       -178.97925593 
       -178.98475419 
   
  
  
      13.23   13.25
      13.43   13.45
   
       -179.12145161 
       -179.11323258 
       -179.11871193 
   
  
  
      10.20   10.24
      11.45   11.49
   
       -146.16970240 
       -146.16582091 
       -146.16840857 
   
  
  
      11.03   11.09
      12.07   12.13
   
       -149.56538979 
       -149.56936330 
       -149.56671429 
   
  
  
      12.73   12.78
      13.77   13.83
   
       -150.57565528 
       -150.58554770 
       -150.57895275 
   
  
  
      11.59   11.64
      12.60   12.66
   
       -156.97006186 
       -156.95900605 
       -156.96637659 
   
  
  
      11.32   11.37
      12.24   12.29
   
       -160.54614424 
       -160.52063889 
       -160.53764245 
   
  
  
      10.96   10.99
      12.00   12.03
   
       -170.16913459 
       -170.15708820 
       -170.16511912 
   
  
  
      11.17   11.25
      12.19   12.27
   
       -176.72577826 
       -176.75812945 
       -176.73656199 
   
  
  
      11.17   11.23
      12.25   12.31
   
       -180.53692159 
       -180.58153142 
       -180.55179154 
   
  
  
      11.61   11.69
      12.78   12.85
   
       -181.69207052 
       -181.72812100 
       -181.70408735 
   
  
  
      11.26   11.30
      12.21   12.25
   
       -182.10601725 
       -182.14055159 
       -182.11752869 
   
  
  
      11.21   11.25
      12.19   12.24
   
       -182.47181980 
       -182.50527357 
       -182.48297105 
   
  
  
      12.38   12.41
      13.31   13.35
   
       -182.58578209 
       -182.61836771 
       -182.59664396