vasp 
  6.2.1  
  16May21 (build Apr 11 2022 11:03:26) complex                          parallel 
  Lin64 
  2024 09 01 
  22:39:07 
 
 
  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 
    
   
   
           0.92423555       0.53894852       0.06851847 
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           0.12335533       0.45817498       0.16304071 
           0.13494007       0.31007418       0.31388564 
           0.80749719       0.33711864       0.01265179 
           0.93797420       0.45934532       0.50926928 
           0.08702053       0.34172578       0.10606902 
           0.15964056       0.42657647       0.36996885 
           0.96743965       0.57734152       0.56089880 
           0.76704789       0.25732937       0.85001169 
           0.19643132       0.55481932       0.71537207 
           0.00510574       0.22824457       0.71784108 
           0.90988896       0.34572071       0.58939462 
           0.84817426       0.44781300       0.92712008 
           0.16586532       0.34296745       0.71270111 
           0.11615221       0.45047457       0.81876955 
           0.42705705       0.45369643       0.11915475 
           0.33239229       0.23665776       0.43228595 
           0.70826055       0.48339217       0.17643923 
           0.56632671       0.28586504       0.32980879 
           0.32898765       0.31616217       0.98236798 
           0.44457114       0.42721174       0.45001036 
           0.54524798       0.33870176       0.13298592 
           0.72789589       0.42154536       0.36190140 
           0.42022426       0.50194229       0.60881151 
           0.27246533       0.23889941       0.82317670 
           0.70734224       0.57123202       0.67946563 
           0.54317162       0.21902194       0.71486290 
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           0.54026512       0.57401295       0.57337233 
           0.60352259       0.61306239       0.78543881 
           0.35038588       0.58407088       0.72262882 
           0.62613387       0.61558776       0.87262709 
   
  
  
           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 
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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
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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     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
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    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
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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 
   
  
  
          0.92423555       0.53894852       0.06851847 
          0.85078579       0.30698188       0.39046167 
          0.12335533       0.45817498       0.16304071 
          0.13494007       0.31007418       0.31388564 
          0.80749719       0.33711864       0.01265179 
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          0.08702053       0.34172578       0.10606902 
          0.15964056       0.42657647       0.36996885 
          0.96743965       0.57734152       0.56089880 
          0.76704789       0.25732937       0.85001169 
          0.19643132       0.55481932       0.71537207 
          0.00510574       0.22824457       0.71784108 
          0.90988896       0.34572071       0.58939462 
          0.84817426       0.44781300       0.92712008 
          0.16586532       0.34296745       0.71270111 
          0.11615221       0.45047457       0.81876955 
          0.42705705       0.45369643       0.11915475 
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          0.70826055       0.48339217       0.17643923 
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          0.32898765       0.31616217       0.98236798 
          0.44457114       0.42721174       0.45001036 
          0.54524798       0.33870176       0.13298592 
          0.72789589       0.42154536       0.36190140 
          0.42022426       0.50194229       0.60881151 
          0.27246533       0.23889941       0.82317670 
          0.70734224       0.57123202       0.67946563 
          0.54317162       0.21902194       0.71486290 
          0.39904539       0.32987460       0.57119058 
          0.38029679       0.42891753       0.91375426 
          0.65529569       0.33937765       0.70107641 
          0.61062099       0.45065784       0.77603649 
          0.54026512       0.57401295       0.57337233 
          0.60352259       0.61306239       0.78543881 
          0.35038588       0.58407088       0.72262882 
          0.62613387       0.61558776       0.87262709 
  
 
 
  
      10.40   10.43
      12.39   12.42
   
         27.86983208 
       9540.05575023 
     -13203.20556552 
       -235.47465233 
       3513.49417245 
      -2953.91778466 
          0.01083717 
       -207.22016182 
       4187.58753671 
        669.19996432 
        669.18912714 
        669.19635193 
   
  
  
      12.82   12.84
      12.82   12.84
   
        -83.11003680 
        -83.10150087 
        -83.10719149 
   
  
  
      12.55   12.58
      12.55   12.58
   
       -174.13580879 
       -174.10547872 
       -174.12569876 
   
  
  
      12.88   12.90
      12.88   12.91
   
       -177.42346871 
       -177.38949874 
       -177.41214539 
   
  
  
      13.23   13.30
      13.60   13.68
   
       -177.55402017 
       -177.51997171 
       -177.54267068 
   
  
  
      11.09   11.12
      13.10   13.14
   
       -146.74520061 
       -146.72119424 
       -146.73719849 
   
  
  
      11.46   11.49
      13.04   13.07
   
       -147.84181380 
       -147.83675072 
       -147.84012611 
   
  
  
      13.28   13.35
      14.80   14.88
   
       -149.05378679 
       -149.05746663 
       -149.05501340 
   
  
  
      11.66   11.74
      12.87   12.96
   
       -155.16407737 
       -155.15930573 
       -155.16248683 
   
  
  
      12.23   12.31
      13.67   13.75
   
       -159.09379354 
       -159.07603105 
       -159.08787271 
   
  
  
      11.13   11.21
      12.41   12.49
   
       -169.41449962 
       -169.41796320 
       -169.41565415 
   
  
  
      11.36   11.44
      12.82   12.90
   
       -175.57738450 
       -175.61118054 
       -175.58864985 
   
  
  
      11.29   11.38
      12.50   12.59
   
       -179.39875604 
       -179.43105890 
       -179.40952366 
   
  
  
      11.96   12.02
      13.33   13.39
   
       -180.41230285 
       -180.44374719 
       -180.42278429 
   
  
  
      10.60   10.67
      11.74   11.88
   
       -180.91417768 
       -180.94522148 
       -180.92452561