vasp 
  6.2.1  
  16May21 (build Apr 11 2022 11:03:26) complex                          parallel 
  Lin64 
  2024 09 02 
  13:13:19 
 
 
  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 
    
   
   
           0.92903769       0.52827021       0.10796116 
           0.85245603       0.23321278       0.42842508 
           0.13563042       0.44837178       0.19590529 
           0.09539225       0.28334612       0.33366169 
           0.81860502       0.33350337       0.02638742 
           0.95730815       0.42176497       0.51833296 
           0.08230585       0.33375591       0.13715764 
           0.19886066       0.40673771       0.39022646 
           0.83205819       0.54540507       0.51990396 
           0.77217399       0.24426488       0.88273225 
           0.06055140       0.51111489       0.65264791 
           0.01590459       0.20569935       0.76289838 
           0.90248757       0.31062088       0.59336900 
           0.86440870       0.44431634       0.95469929 
           0.13901493       0.32358007       0.73681390 
           0.09860979       0.43491164       0.81866648 
           0.42107022       0.46235555       0.12144681 
           0.36614479       0.29064609       0.42153258 
           0.68916762       0.48294947       0.20809521 
           0.64486513       0.31323335       0.34159822 
           0.32673241       0.31855975       0.01072550 
           0.43519030       0.43727537       0.52092206 
           0.56351656       0.34801026       0.14244763 
           0.69318836       0.42913962       0.40073805 
           0.31652340       0.55466073       0.54906914 
           0.27595943       0.23215896       0.86623487 
           0.59877749       0.51694536       0.65327710 
           0.53843941       0.20966107       0.75185006 
           0.39800457       0.32782911       0.62404376 
           0.36860547       0.42746750       0.91966204 
           0.67076147       0.32674902       0.72826099 
           0.63090191       0.43728865       0.81414581 
           0.64909611       0.69624988       0.62712823 
           0.66079341       0.70897476       0.55933423 
           0.45291706       0.57964167       0.67159105 
   
  
  
           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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          0.00000000       0.00000000       0.50000000 
          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
      105
       -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
  
  
        3
        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
         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
      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 
   
  
  
          0.92903769       0.52827021       0.10796116 
          0.85245603       0.23321278       0.42842508 
          0.13563042       0.44837178       0.19590529 
          0.09539225       0.28334612       0.33366169 
          0.81860502       0.33350337       0.02638742 
          0.95730815       0.42176497       0.51833296 
          0.08230585       0.33375591       0.13715764 
          0.19886066       0.40673771       0.39022646 
          0.83205819       0.54540507       0.51990396 
          0.77217399       0.24426488       0.88273225 
          0.06055140       0.51111489       0.65264791 
          0.01590459       0.20569935       0.76289838 
          0.90248757       0.31062088       0.59336900 
          0.86440870       0.44431634       0.95469929 
          0.13901493       0.32358007       0.73681390 
          0.09860979       0.43491164       0.81866648 
          0.42107022       0.46235555       0.12144681 
          0.36614479       0.29064609       0.42153258 
          0.68916762       0.48294947       0.20809521 
          0.64486513       0.31323335       0.34159822 
          0.32673241       0.31855975       0.01072550 
          0.43519030       0.43727537       0.52092206 
          0.56351656       0.34801026       0.14244763 
          0.69318836       0.42913962       0.40073805 
          0.31652340       0.55466073       0.54906914 
          0.27595943       0.23215896       0.86623487 
          0.59877749       0.51694536       0.65327710 
          0.53843941       0.20966107       0.75185006 
          0.39800457       0.32782911       0.62404376 
          0.36860547       0.42746750       0.91966204 
          0.67076147       0.32674902       0.72826099 
          0.63090191       0.43728865       0.81414581 
          0.64909611       0.69624988       0.62712823 
          0.66079341       0.70897476       0.55933423 
          0.45291706       0.57964167       0.67159105 
  
 
 
  
      12.43   12.45
      13.44   13.46
   
         24.76344702 
       9009.96423715 
     -12292.08746690 
       -264.16493725 
       3167.08814863 
      -2605.71786812 
         -0.00770938 
       -196.57556805 
       3755.32434067 
        598.58662378 
        598.59433316 
        598.58919357 
   
  
  
      15.52   15.54
      15.52   15.54
   
        -89.25220354 
        -89.24940336 
        -89.25127015 
   
  
  
      14.79   14.83
      14.80   14.83
   
       -162.76735006 
       -162.74340828 
       -162.75936947 
   
  
  
      15.30   15.34
      15.30   15.34
   
       -165.79569489 
       -165.76999792 
       -165.78712923 
   
  
  
      15.90   15.95
      16.07   16.12
   
       -165.94567798 
       -165.91992398 
       -165.93709331 
   
  
  
      15.82   15.86
      16.66   16.71
   
     -13636.90534369 
     -13636.89973202 
     -13636.90347313 
   
  
  
      12.88   12.93
      13.69   13.74
   
       -123.09802024 
       -123.09381254 
       -123.09661767 
   
  
  
      14.26   14.29
      15.07   15.10
   
       -133.17534515 
       -133.16994495 
       -133.17354508 
   
  
  
      14.62   14.67
      15.42   15.47
   
       -143.40788055 
       -143.37468656 
       -143.39681589 
   
  
  
      14.90   14.96
      15.72   15.78
   
       -138.40678890 
       -138.37773969 
       -138.39710583 
   
  
  
      13.34   13.40
      14.17   14.23
   
       -142.35144249 
       -142.33745123 
       -142.34677874 
   
  
  
      13.56   13.61
      14.38   14.42
   
       -150.23175420 
       -150.23266213 
       -150.23205684 
   
  
  
      12.96   12.99
      13.76   13.80
   
       -156.01792096 
       -156.02676293 
       -156.02086829 
   
  
  
      12.06   12.12
      12.88   12.94
   
       -154.15411319 
       -154.16613490 
       -154.15812043 
   
  
  
      16.15   16.20
      16.96   17.01
   
       -165.86790198 
       -165.87433070 
       -165.87004489 
   
  
  
      19.55   19.60
      20.36   20.40
   
      -5578.60057049 
      -5578.60624795 
      -5578.60246298 
   
  
  
      13.68   13.72
      14.54   14.60
   
       -150.73615876 
       -150.74024653 
       -150.73752135 
   
  
  
      17.25   17.28
      18.11   18.15
   
       -871.09698296 
       -871.07015763 
       -871.08804118 
   
  
  
      14.48   14.52
      15.55   15.59
   
       -158.71046879 
       -158.73463418 
       -158.71852392 
   
  
  
      14.79   14.83
      15.89   15.93
   
       -168.86078005 
       -168.88764978 
       -168.86973663 
   
  
  
      14.72   14.77
      15.87   15.93
   
       -168.06360683 
       -168.08850565 
       -168.07190643 
   
  
  
      14.47   14.53
      15.67   15.72
   
       -173.15622257 
       -173.18155783 
       -173.16466766