vasp 
  6.2.1  
  16May21 (build Apr 11 2022 11:03:26) complex                          parallel 
  Lin64 
  2024 09 01 
  15:39:24 
 
 
  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      0.73000000
  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 
    
   
   
           0.92629517       0.53013197       0.10430953 
           0.85453636       0.23316696       0.43169662 
           0.13062648       0.44964569       0.19607134 
           0.09698682       0.28556698       0.33522008 
           0.81849582       0.33671738       0.02592089 
           0.95563868       0.42327021       0.52051712 
           0.08128989       0.33550029       0.13758786 
           0.19349196       0.40653189       0.38992092 
           0.83471355       0.55074875       0.51217782 
           0.77318972       0.24579169       0.88485710 
           0.05335026       0.51242801       0.65304447 
           0.01878724       0.20767355       0.76691794 
           0.90123457       0.31184948       0.59493982 
           0.86327281       0.44628189       0.94906372 
           0.13909685       0.32518498       0.73841963 
           0.10103910       0.43828988       0.81695446 
           0.41868588       0.46136826       0.12210018 
           0.37036525       0.29504313       0.42154616 
           0.68964993       0.48378217       0.20609569 
           0.65173771       0.31462619       0.34155371 
           0.32662030       0.32115462       0.01099175 
           0.43984398       0.43954537       0.52105338 
           0.56450782       0.35242336       0.14411520 
           0.69482509       0.42882264       0.39889906 
           0.31725033       0.55231834       0.54786487 
           0.27860231       0.23326786       0.87018453 
           0.59592011       0.53675423       0.65942957 
           0.53801584       0.21103746       0.75419155 
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           0.67148980       0.32875727       0.73079141 
           0.63176554       0.44231448       0.80738788 
           0.69739628       0.64102225       0.73240140 
           0.61534017       0.69620348       0.44660610 
           0.43990691       0.57365787       0.67732052 
   
  
  
           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 
  
 
 
  
          2        1        2 
         0.00000000       0.00000000       0.00000000 
         0.50000000       0.00000000       0.00000000 
         0.00000000       1.00000000       0.00000000 
         0.00000000       0.00000000       0.50000000 
         0.00000000       0.00000000       0.00000000 
  
  
          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
      104
       -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  
          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
        -0.02000000
        0
         0.50000000
        -3.00000000
         1.00000000
  
  
         0.00010000
         0.00010000
        1
        1
      256
        16.00000000
  
  
        2
         0.00001000
  
  
        0
         1.11000000      0.32000000      0.73000000
      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
  
  
        1
        4
       -1
    T  
    F  
    F  
    F  
    F  
    F  
  
  
        3
       -1
    F  
        28.08500000      1.00000000     16.00000000
         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
         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
        27.99362752
         1.00000000
  
  
    F  
    F  
    F  
    F  
        0
         0.10000000
        -1.00000000
         0.00200000
        -0.10000000
         0.00000000
         0.00000000      0.00000000      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
        -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  
  
 
 
        35 
         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
    O    3
   
  
  
   type
   atomspertype
   element
   mass
   valence
   pseudopotential
   
      32Si     28.08500000      4.00000000  PAW_PBE Si 05Jan2001                  
       2H       1.00000000      1.00000000  PAW_PBE H 15Jun2001                   
       1O      16.00000000      6.00000000  PAW_PBE O 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 
   
  
  
          0.92629517       0.53013197       0.10430953 
          0.85453636       0.23316696       0.43169662 
          0.13062648       0.44964569       0.19607134 
          0.09698682       0.28556698       0.33522008 
          0.81849582       0.33671738       0.02592089 
          0.95563868       0.42327021       0.52051712 
          0.08128989       0.33550029       0.13758786 
          0.19349196       0.40653189       0.38992092 
          0.83471355       0.55074875       0.51217782 
          0.77318972       0.24579169       0.88485710 
          0.05335026       0.51242801       0.65304447 
          0.01878724       0.20767355       0.76691794 
          0.90123457       0.31184948       0.59493982 
          0.86327281       0.44628189       0.94906372 
          0.13909685       0.32518498       0.73841963 
          0.10103910       0.43828988       0.81695446 
          0.41868588       0.46136826       0.12210018 
          0.37036525       0.29504313       0.42154616 
          0.68964993       0.48378217       0.20609569 
          0.65173771       0.31462619       0.34155371 
          0.32662030       0.32115462       0.01099175 
          0.43984398       0.43954537       0.52105338 
          0.56450782       0.35242336       0.14411520 
          0.69482509       0.42882264       0.39889906 
          0.31725033       0.55231834       0.54786487 
          0.27860231       0.23326786       0.87018453 
          0.59592011       0.53675423       0.65942957 
          0.53801584       0.21103746       0.75419155 
          0.39995655       0.32827469       0.62601276 
          0.37153517       0.42951881       0.91572715 
          0.67148980       0.32875727       0.73079141 
          0.63176554       0.44231448       0.80738788 
          0.69739628       0.64102225       0.73240140 
          0.61534017       0.69620348       0.44660610 
          0.43990691       0.57365787       0.67732052 
  
 
 
  
      14.72   14.85
      15.42   15.55
   
         24.76344702 
       9098.79293666 
     -12373.50077266 
       -264.46665556 
       3167.08814863 
      -2605.71786812 
          0.00928461 
       -191.83897851 
       3755.32434067 
        610.45388275 
        610.44459814 
        610.45078788 
   
  
  
      18.46   18.46
      18.46   18.46
   
        -87.32936304 
        -87.30729116 
        -87.32200575 
   
  
  
      17.41   17.41
      17.41   17.41
   
       -162.96094147 
       -162.94847211 
       -162.95678501 
   
  
  
      18.11   18.11
      18.11   18.11
   
       -165.91838085 
       -165.90412173 
       -165.91362781 
   
  
  
      19.30   19.30
      19.51   19.51
   
       -166.05844481 
       -166.04404281 
       -166.05364414 
   
  
  
      15.27   15.26
      16.12   16.12
   
       -141.38497117 
       -141.35511239 
       -141.37501825 
   
  
  
      15.67   15.67
      16.50   16.50
   
       -137.18734265 
       -137.15548795 
       -137.17672442 
   
  
  
      17.18   17.18
      18.02   18.02
   
       -137.62690084 
       -137.59867766 
       -137.61749311 
   
  
  
      16.66   16.66
      17.50   17.50
   
       -142.14804229 
       -142.13868731 
       -142.14492396 
   
  
  
      16.23   16.23
      17.09   17.09
   
       -145.53529873 
       -145.53765873 
       -145.53608539 
   
  
  
      16.40   16.40
      17.24   17.24
   
       -154.72318481 
       -154.74621157 
       -154.73086040 
   
  
  
      15.71   15.71
      16.54   16.54
   
       -161.70920162 
       -161.74505097 
       -161.72115140 
   
  
  
      17.38   17.37
      18.18   18.18
   
       -165.11908935 
       -165.14969900 
       -165.12929257 
   
  
  
      16.36   16.36
      17.16   17.16
   
       -166.26293295 
       -166.30054324 
       -166.27546971 
   
  
  
      17.19   17.19
      18.00   18.00
   
       -166.88221355 
       -166.91616822 
       -166.89353177 
   
  
  
      17.94   17.94
      18.73   18.73
   
       -167.27705485 
       -167.28589474 
       -167.28000148 
   
  
  
      15.86   15.86
      16.66   16.65
   
       -167.25381581 
       -167.27091077 
       -167.25951413 
   
  
  
      15.13   15.13
      16.00   16.01
   
       -167.32798576 
       -167.36097367 
       -167.33898173 
   
  
  
      16.07   16.07
      16.96   16.96
   
       -167.52192411 
       -167.54684839 
       -167.53023221 
   
  
  
      16.10   16.10
      16.97   16.97
   
       -167.53596900 
       -167.57140462 
       -167.54778087 
   
  
  
      17.60   17.60
      18.47   18.46
   
       -167.54662262 
       -167.57839697 
       -167.55721407 
   
  
  
      16.21   16.21
      17.08   17.08
   
       -167.47068566 
       -167.50031420 
       -167.48056184 
   
  
  
      16.74   16.74
      17.61   17.61
   
       -167.39230822 
       -167.42149806 
       -167.40203817 
   
  
  
      16.98   16.98
      17.84   17.84
   
       -167.26229147 
       -167.29133011 
       -167.27197102 
   
  
  
      17.31   17.31
      18.21   18.21
   
       -167.07345683 
       -167.10240470 
       -167.08310612 
   
  
  
      17.15   17.15
      18.03   18.02
   
       -166.81333771 
       -166.84221988 
       -166.82296510 
   
  
  
      17.85   17.85
      18.74   18.74
   
       -166.70490464 
       -166.73377122 
       -166.71452684 
   
  
  
      16.42   16.42
      17.42   17.42
   
       -166.76553225 
       -166.79441392 
       -166.77515947 
   
  
  
      15.96   15.95
      16.89   16.89
   
       -166.96602419 
       -166.99494259 
       -166.97566366 
   
  
  
      16.37   16.37
      17.28   17.28
   
       -167.24020177 
       -167.26919311 
       -167.24986555