vasp 
  6.2.1  
  16May21 (build Apr 11 2022 11:03:26) complex                          parallel 
  Lin64 
  2025 09 01 
  23:35:11 
 
 
  No title
       0
  Normal
  Normal (blocked Davidson)
   F  
       1
       2
       1
      60
       2
      -1
        0.00001000
       -0.02000000
       0
       2
       1
      400.00000000
        1.11000000      0.73000000      0.77000000      0.32000000      0.75000000
  Auto
       1
        0.20000000
       1
   F  
   F  
       1
 
 
  
   
    
           12.00000000       0.00000000       0.00000000 
            0.00000000      12.00000000       0.00000000 
            0.00000000       0.00000000      15.00000000 
    
       2160.00000000 
    
            0.08333333       0.00000000       0.00000000 
            0.00000000       0.08333333       0.00000000 
            0.00000000       0.00000000       0.06666667 
    
   
   
           0.37274975       0.35568950       0.33619098 
           0.45057186       0.50988334       0.49354317 
           0.40629622       0.40688228       0.43391982 
           0.36187711       0.61337929       0.47071053 
           0.44980388       0.47781287       0.59851051 
           0.57947209       0.54553367       0.47504915 
           0.42542986       0.45410194       0.26869389 
           0.43282662       0.23740560       0.31019487 
           0.24064474       0.34905329       0.31371888 
           0.37180216       0.72042142       0.50315958 
           0.35760075       0.43108624       0.64539383 
           0.62298995       0.59309888       0.39529436 
           0.41367414       0.45213220       0.17429867 
           0.54633192       0.22145591       0.30202942 
           0.16675310       0.43964493       0.32291816 
           0.28378021       0.72713084       0.59633990 
           0.43681151       0.73828830       0.54616860 
           0.34945380       0.77843327       0.47023140 
           0.37091798       0.36630203       0.67300206 
           0.33583274       0.47504027       0.68699889 
           0.29640014       0.41396476       0.61539922 
           0.70444455       0.55501027       0.38207725 
           0.56821761       0.57848528       0.33761037 
           0.63490287       0.68321562       0.40450060 
           0.49639599       0.45772956       0.14331017 
           0.37252581       0.37602897       0.15035534 
           0.36429481       0.52453462       0.15230806 
           0.55208730       0.16349701       0.26566608 
           0.59562912       0.27972119       0.27886422 
           0.58165370       0.20439375       0.35411100 
           0.18032473       0.48122247       0.38487576 
           0.17592666       0.49852830       0.26931390 
           0.08235431       0.40913793       0.31981891 
           0.20172223       0.87492778       0.59616403 
           0.27858101       0.90799941       0.65956314 
           0.26271247       0.54017212       0.60856264 
   
  
  
           1 
           2 
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           4 
           5 
           6 
           7 
           8 
           9 
          10 
          11 
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          13 
          14 
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          24 
          25 
          26 
          27 
          28 
          29 
          30 
          31 
          32 
          33 
          34 
          35 
          36 
  
 
 
  
          2        2        1 
         0.00000000       0.00000000       0.00000000 
         0.50000000       0.00000000       0.00000000 
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         0.00000000       0.00000000       0.00000000 
  
  
          0.00000000       0.00000000       0.00000000 
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          0.00000000       0.50000000       0.00000000 
          0.50000000       0.50000000       0.00000000 
  
  
          0.25000000 
          0.25000000 
          0.25000000 
          0.25000000 
  
 
 
  
   No title
    F  
  
  
   normal
       400.00000000
       644.87300000
         0.00001000
       38
       10
       68
       -1
       -1
        99.00000000
        0
        0
        0
        0
         0.00000000
   
         1
          0.20000000
          0.50000000
     T  
     T  
   
   
     T  
         -0.00050000     -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      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  
   
   
        60
        -5
         2
        400.00000000
    
      T  
      F  
           0.00000000
           0.00000004
           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
   
  
  
       60
       60
       80
      120
      120
      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      0.75000000
      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
  
  
        4
        4
       -1
    T  
    F  
    F  
    F  
    F  
    F  
  
  
        3
       -1
    F  
        28.08500000     16.00000000     12.01100000      1.00000000     14.00100000
         0.00000000      0.00000000      0.00000000      0.00000000      0.00000000
         1.00000000      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
        36.00000000
         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
       60
        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  
  
 
 
        36 
         5 
  
   ion
   element
   atomtype
   
    Si   1
    Si   1
    O    2
    O    2
    O    2
    O    2
    O    2
    O    2
    O    2
    C    3
    C    3
    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
    H    4
    H    4
    H    4
    H    4
    H    4
    H    4
    H    4
    N    5
   
  
  
   type
   atomspertype
   element
   mass
   valence
   pseudopotential
   
       2Si     28.08500000      4.00000000  PAW_PBE Si 05Jan2001                  
       7O      16.00000000      6.00000000  PAW_PBE O 08Apr2002                   
       6C      12.01100000      4.00000000  PAW_PBE C 08Apr2002                   
      20H       1.00000000      1.00000000  PAW_PBE H 15Jun2001                   
       1N      14.00100000      5.00000000  PAW_PBE N 08Apr2002                   
   
  
 
 
  
   
          12.00000000       0.00000000       0.00000000 
           0.00000000      12.00000000       0.00000000 
           0.00000000       0.00000000      15.00000000 
   
      2160.00000000 
   
           0.08333333       0.00000000       0.00000000 
           0.00000000       0.08333333       0.00000000 
           0.00000000       0.00000000       0.06666667 
   
  
  
          0.37274975       0.35568950       0.33619098 
          0.45057186       0.50988334       0.49354317 
          0.40629622       0.40688228       0.43391982 
          0.36187711       0.61337929       0.47071053 
          0.44980388       0.47781287       0.59851051 
          0.57947209       0.54553367       0.47504915 
          0.42542986       0.45410194       0.26869389 
          0.43282662       0.23740560       0.31019487 
          0.24064474       0.34905329       0.31371888 
          0.37180216       0.72042142       0.50315958 
          0.35760075       0.43108624       0.64539383 
          0.62298995       0.59309888       0.39529436 
          0.41367414       0.45213220       0.17429867 
          0.54633192       0.22145591       0.30202942 
          0.16675310       0.43964493       0.32291816 
          0.28378021       0.72713084       0.59633990 
          0.43681151       0.73828830       0.54616860 
          0.34945380       0.77843327       0.47023140 
          0.37091798       0.36630203       0.67300206 
          0.33583274       0.47504027       0.68699889 
          0.29640014       0.41396476       0.61539922 
          0.70444455       0.55501027       0.38207725 
          0.56821761       0.57848528       0.33761037 
          0.63490287       0.68321562       0.40450060 
          0.49639599       0.45772956       0.14331017 
          0.37252581       0.37602897       0.15035534 
          0.36429481       0.52453462       0.15230806 
          0.55208730       0.16349701       0.26566608 
          0.59562912       0.27972119       0.27886422 
          0.58165370       0.20439375       0.35411100 
          0.18032473       0.48122247       0.38487576 
          0.17592666       0.49852830       0.26931390 
          0.08235431       0.40913793       0.31981891 
          0.20172223       0.87492778       0.59616403 
          0.27858101       0.90799941       0.65956314 
          0.26271247       0.54017212       0.60856264