vasp 
  6.2.1  
  16May21 (build Apr 11 2022 11:03:26) complex                          parallel 
  Lin64 
  2024 09 01 
  09:32:45 
 
 
  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      0.75000000
  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 
    
   
   
           0.87469664       0.51173812       0.10922937 
           0.87250678       0.24045361       0.43078223 
           0.13758539       0.46437286       0.18398712 
           0.12218642       0.29205978       0.34543886 
           0.82936215       0.32990636       0.02834061 
           0.92269548       0.41679195       0.50358309 
           0.08388223       0.33973449       0.15083579 
           0.16840503       0.41375152       0.37613044 
           0.81938840       0.54727163       0.52298749 
           0.77558464       0.24326682       0.88029501 
           0.05741195       0.49976227       0.63355494 
           0.03131722       0.20684829       0.77152517 
           0.88971286       0.31079189       0.60634530 
           0.85615693       0.43954902       0.93841423 
           0.14881829       0.32419378       0.72711604 
           0.10518153       0.43400209       0.81517022 
           0.38350359       0.52354549       0.10787877 
           0.37384446       0.24137439       0.43414646 
           0.62154753       0.45895327       0.19111890 
           0.62076908       0.29235547       0.35258957 
           0.33491176       0.33458755       0.03003756 
           0.41218590       0.43194735       0.51155762 
           0.58708126       0.33918129       0.15621976 
           0.67103342       0.45636379       0.40465845 
           0.29864228       0.54641218       0.52770525 
           0.27051196       0.24688171       0.88457408 
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           0.52369948       0.20845993       0.77635202 
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           0.60302039       0.43513628       0.81664217 
           0.68183223       0.70754227       0.65418860 
           0.68636159       0.69336121       0.59127978 
           0.47045972       0.63008187       0.63967407 
           0.43459631       0.58092480       0.64563813 
   
  
  
           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 
         0.50000000       0.00000000       0.00000000 
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         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
       627.11200000
         0.00001000
       38
       10
      106
       -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  
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      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
         0.00010000
        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
  
  
        2
        4
       -1
    T  
    F  
    F  
    F  
    F  
    F  
  
  
        3
       -1
    F  
        28.08500000      1.00000000     14.00100000
         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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         0.00200000
        -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
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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
    H    2
    H    2
    H    2
    N    3
   
  
  
   type
   atomspertype
   element
   mass
   valence
   pseudopotential
   
      32Si     28.08500000      4.00000000  PAW_PBE Si 05Jan2001                  
       3H       1.00000000      1.00000000  PAW_PBE H 15Jun2001                   
       1N      14.00100000      5.00000000  PAW_PBE N 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 
   
  
  
          0.87469664       0.51173812       0.10922937 
          0.87250678       0.24045361       0.43078223 
          0.13758539       0.46437286       0.18398712 
          0.12218642       0.29205978       0.34543886 
          0.82936215       0.32990636       0.02834061 
          0.92269548       0.41679195       0.50358309 
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          0.16840503       0.41375152       0.37613044 
          0.81938840       0.54727163       0.52298749 
          0.77558464       0.24326682       0.88029501 
          0.05741195       0.49976227       0.63355494 
          0.03131722       0.20684829       0.77152517 
          0.88971286       0.31079189       0.60634530 
          0.85615693       0.43954902       0.93841423 
          0.14881829       0.32419378       0.72711604 
          0.10518153       0.43400209       0.81517022 
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          0.67103342       0.45636379       0.40465845 
          0.29864228       0.54641218       0.52770525 
          0.27051196       0.24688171       0.88457408 
          0.58409719       0.51430929       0.65131951 
          0.52369948       0.20845993       0.77635202 
          0.39470933       0.31986396       0.59683931 
          0.35462465       0.44495047       0.94208940 
          0.64058784       0.32477576       0.72843934 
          0.60302039       0.43513628       0.81664217 
          0.68183223       0.70754227       0.65418860 
          0.68636159       0.69336121       0.59127978 
          0.47045972       0.63008187       0.63967407 
          0.43459631       0.58092480       0.64563813 
  
 
 
  
      13.33   13.42
      13.77   13.87
   
         24.83226377 
       8710.54232169 
     -11851.71524985 
       -270.15818361 
       3027.27271826 
      -2465.30175395 
         -0.01809651 
       -194.60525748 
       3600.01477972 
        580.86354204 
        580.88163855 
        580.86957421 
   
  
  
      16.20   16.22
      16.20   16.22
   
        -95.84750541 
        -95.82940359 
        -95.84147147 
   
  
  
      15.75   15.77
      15.76   15.77
   
       -166.45022513 
       -166.45196706 
       -166.45080578 
   
  
  
      16.35   16.37
      16.36   16.37
   
       -169.39295268 
       -169.39747812 
       -169.39446116 
   
  
  
      17.20   17.24
      17.37   17.41
   
       -169.52620680 
       -169.53079102 
       -169.52773487 
   
  
  
      18.17   18.19
      18.77   18.79
   
     -15656.48166886 
     -15656.49566174 
     -15656.48633316 
   
  
  
      14.78   14.81
      15.38   15.41
   
       -114.69926944 
       -114.67904077 
       -114.69252655 
   
  
  
      17.21   17.23
      17.82   17.84
   
       -143.23478799 
       -143.23528715 
       -143.23495437