vasp 
  6.2.1  
  16May21 (build Apr 11 2022 11:03:26) complex                          parallel 
  Lin64 
  2024 09 18 
  21:01:17 
 
 
  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      0.99000000      0.32000000      0.75000000
        0.00800000      0.00100000      0.00500000      0.00100000     -0.00100000     -0.00100000      0.05400000     -0.00900000      0.00100000      0.01000000      0.00100000      0.00500000      0.00000000      0.00100000     -0.00400000      0.00000000      0.01400000      0.00200000      0.00100000      0.00000000
      0.00900000      0.00400000      0.00100000     -0.03000000     -0.00400000      0.00200000     -0.01100000      0.04200000      0.01000000      0.00600000      0.00000000      0.00000000      0.00100000     -0.00200000     -0.01100000      0.02000000     -0.00100000      0.00200000      0.00000000      0.00100000
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      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      0.00000000
  Auto
       1
        0.20000000
       1
   F  
   F  
       1
 
 
  
   
    
            7.66310000       0.00000000       0.00000000 
            0.00000000      25.32620000       0.00000000 
            0.00000000       0.00000000      10.83726000 
    
       2103.26511137 
    
            0.13049549       0.00000000       0.00000000 
            0.00000000       0.03948480       0.00000000 
            0.00000000       0.00000000       0.09227425 
    
   
   
           0.01153316       0.46213745       0.07682899 
           0.99716009       0.54392217       0.42922861 
           0.26800618       0.46255383       0.19122469 
           0.24410238       0.54266604       0.30211985 
           0.00000000       0.23711251       0.43249270 
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           0.25000000       0.31002987       0.18689016 
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           0.25000000       0.23711251       0.81750730 
           0.00000000       0.31002987       0.56310984 
           0.25000000       0.31002987       0.68689016 
           0.00000000       0.38653400       0.93672229 
           0.25000000       0.38653400       0.81327771 
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           0.74247744       0.54486418       0.30845664 
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           0.74985769       0.46660873       0.68073072 
           0.74669724       0.53325752       0.84264784 
           0.50000000       0.23711251       0.93249270 
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           0.45993844       0.62489917       0.46233116 
           0.00190818       0.60003554       0.50886249 
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           0.00797321       0.59394755       0.04743260 
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           0.78010277       0.18258734       0.22853111 
           0.50979763       0.18435547       0.02956752 
           0.81729433       0.18056118       0.75321742 
           0.62838726       0.71125971       0.30346106 
           0.79795342       0.62822507       0.76227753 
           0.55617152       0.72436084       0.60589554 
           0.06434085       0.71905301       0.65471014 
           0.07349399       0.60061917       0.58497869 
           0.14902932       0.59854721       0.14771078 
           0.90254950       0.59635811       0.10418147 
           0.64958697       0.59895405       0.14555576 
           0.39427820       0.60515073       0.10144901 
           0.80536520       0.45218486       0.94944856 
           0.18288357       0.72034938       0.49110498 
           0.21028611       0.71350004       0.33678592 
           0.99535763       0.14904845       0.48979116 
           0.12431215       0.17428850       0.19332893 
           0.05333990       0.17244506       0.77464652 
           0.69650787       0.17855808       0.15965677 
           0.40943053       0.18084389       0.08679330 
           0.85393818       0.18251476       0.66465662 
           0.27778316       0.76926367       0.40839069 
           0.26993352       0.72743532       0.41567351 
   
  
  
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          73 
          74 
  
 
 
  
          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 
          0.50000000       0.00000000       0.00000000 
          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
       627.11200000
         0.00001000
       38
       10
      186
       -1
       -1
       292.00000000
        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
   
   
         2
     F  
          0.00800000      0.00100000      0.00500000      0.00100000     -0.00100000     -0.00100000      0.05400000     -0.00900000      0.00100000      0.01000000      0.00100000      0.00500000      0.00000000      0.00100000     -0.00400000      0.00000000      0.01400000      0.00200000      0.00100000      0.00000000
      0.00900000      0.00400000      0.00100000     -0.03000000     -0.00400000      0.00200000     -0.01100000      0.04200000      0.01000000      0.00600000      0.00000000      0.00000000      0.00100000     -0.00200000     -0.01100000      0.02000000     -0.00100000      0.00200000      0.00000000      0.00100000
      0.00100000      0.00100000      0.00000000      0.00000000      0.00100000      0.00000000      0.00000000      0.00200000      0.00000000      0.00500000     -0.00100000      0.01000000      0.00000000     -0.00200000      0.00000000      0.00100000      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      0.00000000      0.00000000      0.00000000      0.00000000      0.00000000
         -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
           0.00000001
           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
      126
       54
       80
      252
      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      0.73000000      0.99000000      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
  
  
        3
        4
       -1
    T  
    F  
    F  
    F  
    F  
    F  
  
  
        3
       -1
    F  
        28.08500000     16.00000000     35.45300000      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
        17.05350090
         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  
  
 
 
        74 
         5 
  
   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
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    O    2
    O    2
    O    2
    O    2
    O    2
    O    2
    O    2
    O    2
    O    2
    O    2
    O    2
    O    2
    O    2
    O    2
    Cl   3
    Cl   3
    Cl   3
    Cl   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
    N    5
   
  
  
   type
   atomspertype
   element
   mass
   valence
   pseudopotential
   
      40Si     28.08500000      4.00000000  PAW_PBE Si 05Jan2001                  
      14O      16.00000000      6.00000000  PAW_PBE O 08Apr2002                   
       4Cl     35.45300000      7.00000000  PAW_PBE Cl 06Sep2000                  
      15H       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      25.32620000       0.00000000 
           0.00000000       0.00000000      10.83726000 
   
      2103.26511137 
   
           0.13049549       0.00000000       0.00000000 
           0.00000000       0.03948480       0.00000000 
           0.00000000       0.00000000       0.09227425 
   
  
  
          0.01153316       0.46213745       0.07682899 
          0.99716009       0.54392217       0.42922861 
          0.26800618       0.46255383       0.19122469 
          0.24410238       0.54266604       0.30211985 
          0.00000000       0.23711251       0.43249270 
          0.25000000       0.23711251       0.31750730 
          0.00000000       0.31002987       0.06310984 
          0.25000000       0.31002987       0.18689016 
          0.00000000       0.38653400       0.43672229 
          0.25000000       0.38653400       0.31327771 
          0.00003532       0.46603672       0.55507796 
          0.00665577       0.54001984       0.95438358 
          0.24835438       0.46745255       0.68855905 
          0.23321086       0.54799263       0.81124816 
          0.25000000       0.23711251       0.81750730 
          0.00000000       0.31002987       0.56310984 
          0.25000000       0.31002987       0.68689016 
          0.00000000       0.38653400       0.93672229 
          0.25000000       0.38653400       0.81327771 
          0.50841745       0.46733989       0.05099186 
          0.48685288       0.55575303       0.42739781 
          0.74407962       0.46426018       0.19622891 
          0.74247744       0.54486418       0.30845664 
          0.50000000       0.23711251       0.43249270 
          0.75000000       0.23711251       0.31750730 
          0.50000000       0.31002987       0.06310984 
          0.75000000       0.31002987       0.18689016 
          0.50000000       0.38653400       0.43672229 
          0.75000000       0.38653400       0.31327771 
          0.49624556       0.47125622       0.55533932 
          0.47892344       0.55229443       0.94070761 
          0.74985769       0.46660873       0.68073072 
          0.74669724       0.53325752       0.84264784 
          0.50000000       0.23711251       0.93249270 
          0.75000000       0.23711251       0.81750730 
          0.75000000       0.31002987       0.68689016 
          0.50000000       0.38653400       0.93672229 
          0.75000000       0.38653400       0.81327771 
          0.08449840       0.65581339       0.80491202 
          0.48109546       0.68767696       0.44956199 
          0.18595626       0.60386915       0.72789801 
          0.45993844       0.62489917       0.46233116 
          0.00190818       0.60003554       0.50886249 
          0.24820873       0.59739380       0.21081366 
          0.00797321       0.59394755       0.04743260 
          0.75212712       0.59449212       0.20289932 
          0.49061304       0.60430426       0.03785764 
          0.69984671       0.47380798       0.93003988 
          0.98426674       0.18332373       0.52968795 
          0.24273403       0.18312612       0.22030328 
          0.17953863       0.17707137       0.79112796 
          0.78010277       0.18258734       0.22853111 
          0.50979763       0.18435547       0.02956752 
          0.81729433       0.18056118       0.75321742 
          0.62838726       0.71125971       0.30346106 
          0.79795342       0.62822507       0.76227753 
          0.55617152       0.72436084       0.60589554 
          0.06434085       0.71905301       0.65471014 
          0.07349399       0.60061917       0.58497869 
          0.14902932       0.59854721       0.14771078 
          0.90254950       0.59635811       0.10418147 
          0.64958697       0.59895405       0.14555576 
          0.39427820       0.60515073       0.10144901 
          0.80536520       0.45218486       0.94944856 
          0.18288357       0.72034938       0.49110498 
          0.21028611       0.71350004       0.33678592 
          0.99535763       0.14904845       0.48979116 
          0.12431215       0.17428850       0.19332893 
          0.05333990       0.17244506       0.77464652 
          0.69650787       0.17855808       0.15965677 
          0.40943053       0.18084389       0.08679330 
          0.85393818       0.18251476       0.66465662 
          0.27778316       0.76926367       0.40839069 
          0.26993352       0.72743532       0.41567351 
  
  
     T  T  T 
     T  T  T 
     T  T  T 
     T  T  T 
     F  F  F 
     F  F  F 
     F  F  F 
     F  F  F 
     F  F  F 
     F  F  F 
     T  T  T 
     T  T  T 
     T  T  T 
     T  T  T 
     F  F  F 
     F  F  F 
     F  F  F 
     F  F  F 
     F  F  F 
     T  T  T 
     T  T  T 
     T  T  T 
     T  T  T 
     F  F  F 
     F  F  F 
     F  F  F 
     F  F  F 
     F  F  F 
     F  F  F 
     T  T  T 
     T  T  T 
     T  T  T 
     T  T  T 
     F  F  F 
     F  F  F 
     F  F  F 
     F  F  F 
     F  F  F 
     T  T  T 
     T  T  T 
     T  T  T 
     T  T  T 
     T  T  T 
     T  T  T 
     T  T  T 
     T  T  T 
     T  T  T 
     T  T  T 
     T  T  T 
     T  T  T 
     T  T  T 
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     T  T  T 
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     T  T  T 
     T  T  T 
     T  T  T 
     T  T  T 
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     T  T  T 
     T  T  T 
     T  T  T 
     T  T  T 
     T  T  T 
     T  T  T 
     T  T  T 
     T  T  T 
     F  F  F 
     T  T  T 
  
  
         -3.00000000       0.00000000       0.00010000       0.00010000