vasp 
  6.1.1  
  19Jun20 (build Jun 25 2020 02:42:34) complex                          parallel 
  Lin64 
  2021 06 20 
  09:02:44 
 
 
   No title
       0
   Normal
   Normal (blocked Davidson)
   F  
       1
       2
       1
      60
       2
      -1
        0.00001000
       -0.02000000
       0
       2
       1
      250.00000000
        1.11000000      0.32000000
   Auto
       1
        0.20000000
       1
   F  
   F  
       4
   Normal (blocked Davidson)
      60
       1
        0.00001000
       1
 
 
  
   
          15.36108000       0.00000000       0.00000000 
           0.00000000      15.36108000       0.00000000 
           0.00000000       0.00000000      20.86192000 
   
      4922.63661360 
   
           0.06509959       0.00000000       0.00000000 
           0.00000000       0.06509959       0.00000000 
           0.00000000       0.00000000       0.04793423 
   
  
  
          0.06393382       0.13072863       0.60050330 
          0.18753452       0.12508260       0.40299708 
          0.06253452       0.12508260       0.33720303 
          0.19056033       0.13330861       0.66759619 
          0.06256040       0.00037923       0.53647494 
          0.18753452       0.00008260       0.46802969 
          0.06253452       0.00008260       0.27136022 
          0.12993124       0.00411509       0.70602717 
          0.06505565       0.37468049       0.60412710 
          0.18753452       0.37508260       0.40299708 
          0.06253452       0.37508260       0.33720303 
          0.19381437       0.36614528       0.66817812 
          0.06274416       0.25326916       0.53370460 
          0.18753452       0.25008260       0.46802969 
          0.06253452       0.25008260       0.27136022 
          0.22901750       0.24897212       0.73798905 
          0.06284784       0.62364919       0.60197626 
          0.18753452       0.62508260       0.40299708 
          0.06253452       0.62508260       0.33720303 
          0.19183982       0.62300285       0.66455899 
          0.06283062       0.49851888       0.53627702 
          0.18753452       0.50008260       0.46802969 
          0.06253452       0.50008260       0.27136022 
          0.25730852       0.49568122       0.70097717 
          0.06213620       0.86868358       0.59834732 
          0.18753452       0.87508260       0.40299708 
          0.06253452       0.87508260       0.33720303 
          0.18716826       0.87543840       0.66416486 
          0.06247682       0.74577660       0.53290840 
          0.18753452       0.75008260       0.46802969 
          0.06253452       0.75008260       0.27136022 
          0.25669810       0.74998455       0.70121349 
          0.31140625       0.11946405       0.59866219 
          0.43753452       0.12508260       0.40299708 
          0.31253452       0.12508260       0.33720303 
          0.43831368       0.12458093       0.66305728 
          0.31233184       0.00079656       0.53010551 
          0.43753452       0.00008260       0.46802969 
          0.31253452       0.00008260       0.27136022 
          0.49958111       0.99650149       0.70438680 
          0.31276172       0.37430941       0.59453782 
          0.43753452       0.37508260       0.40299708 
          0.31253452       0.37508260       0.33720303 
          0.43303101       0.38360974       0.66671357 
          0.31209634       0.24626228       0.53321813 
          0.43753452       0.25008260       0.46802969 
          0.31253452       0.25008260       0.27136022 
          0.37431332       0.25270472       0.70196929 
          0.31594141       0.62625937       0.59375748 
          0.43753452       0.62508260       0.40299708 
          0.31253452       0.62508260       0.33720303 
          0.43032590       0.62348037       0.66845954 
          0.31275005       0.50007118       0.53074639 
          0.43753452       0.50008260       0.46802969 
          0.31253452       0.50008260       0.27136022 
          0.40119888       0.50164265       0.73648067 
          0.31350608       0.88140231       0.59870833 
          0.43753452       0.87508260       0.40299708 
          0.31253452       0.87508260       0.33720303 
          0.43545037       0.86818645       0.66675533 
          0.31279786       0.75437723       0.53317733 
          0.43753452       0.75008260       0.46802969 
          0.31253452       0.75008260       0.27136022 
          0.40133344       0.74807427       0.73348789 
          0.56373815       0.13138697       0.59773691 
          0.68753452       0.12508260       0.40299708 
          0.56253452       0.12508260       0.33720303 
          0.68312785       0.11606508       0.66783456 
          0.56252730       0.00019590       0.53605889 
          0.68753452       0.00008260       0.46802969 
          0.56253452       0.00008260       0.27136022 
          0.64483469       0.00027360       0.73787318 
          0.56253959       0.37709673       0.60406047 
          0.68753452       0.37508260       0.40299708 
          0.56253452       0.37508260       0.33720303 
          0.69293610       0.38337427       0.66572990 
          0.56281159       0.25549260       0.53361739 
          0.68753452       0.25008260       0.46802969 
          0.56253452       0.25008260       0.27136022 
          0.73899450       0.24850531       0.70284860 
          0.56089899       0.62434446       0.60571668 
          0.68753452       0.62508260       0.40299708 
          0.56253452       0.62508260       0.33720303 
          0.69271824       0.61751989       0.66601903 
          0.56217321       0.50124154       0.53659293 
          0.68753452       0.50008260       0.46802969 
          0.56253452       0.50008260       0.27136022 
          0.72366257       0.50012804       0.73806122 
          0.56197372       0.86990264       0.59964855 
          0.68753452       0.87508260       0.40299708 
          0.56253452       0.87508260       0.33720303 
          0.68338622       0.88335405       0.66870628 
          0.56248962       0.74566576       0.53440351 
          0.68753452       0.75008260       0.46802969 
          0.56253452       0.75008260       0.27136022 
          0.73447880       0.75109434       0.70867234 
          0.81236388       0.11959009       0.60332454 
          0.93753452       0.12508260       0.40299708 
          0.81253452       0.12508260       0.33720303 
          0.94089067       0.11969988       0.66801055 
          0.81278599       0.00028977       0.53140470 
          0.93753452       0.00008260       0.46802969 
          0.81253452       0.00008260       0.27136022 
          0.98312065       0.99993574       0.73211840 
          0.81118319       0.37385167       0.59312029 
          0.93753452       0.37508260       0.40299708 
          0.81253452       0.37508260       0.33720303 
          0.93367963       0.37106597       0.66416117 
          0.81280388       0.24414052       0.53381512 
          0.93753452       0.25008260       0.46802969 
          0.81253452       0.25008260       0.27136022 
          0.88741690       0.24640083       0.71706103 
          0.81012000       0.62695642       0.59294996 
          0.93753452       0.62508260       0.40299708 
          0.81253452       0.62508260       0.33720303 
          0.93294868       0.62621406       0.66341812 
          0.81236404       0.50026340       0.53035561 
          0.93753452       0.50008260       0.46802969 
          0.81253452       0.50008260       0.27136022 
          0.86693980       0.49854012       0.69942226 
          0.81189765       0.88055154       0.60349998 
          0.93753452       0.87508260       0.40299708 
          0.81253452       0.87508260       0.33720303 
          0.94140810       0.88117102       0.66756309 
          0.81246504       0.75642004       0.53371934 
          0.93753452       0.75008260       0.46802969 
          0.81253452       0.75008260       0.27136022 
          0.88302585       0.75352032       0.70995972 
          0.75567154       0.75620808       0.91459721 
          0.78750968       0.66623285       0.90823255 
          0.66408336       0.76063952       0.89085419 
          0.81943235       0.81260859       0.87954288 
          0.75329860       0.78747520       0.98325627 
  
 
 
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        132 
        133 
 
 
  
          1        1        1 
         0.00000000       0.00000000       0.00000000 
         1.00000000       0.00000000       0.00000000 
         0.00000000       1.00000000       0.00000000 
         0.00000000       0.00000000       1.00000000 
         0.00000000       0.00000000       0.00000000 
  
  
          0.00000000       0.00000000       0.00000000 
  
  
          1.00000000 
  
 
 
  
   No title
    F  
  
  
   normal
       250.00000000
       400.00000000
         0.00001000
       38
       10
      328
       -1
       -1
       520.00000000
        0
        0
        0
        0
         0.00000000
   
         1
          0.20000000
          0.50000000
     T  
     T  
   
   
     T  
         -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      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      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      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
        250.00000000
    
      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
   
  
  
       60
       60
       84
      120
      120
      168
    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
      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      1.00000000
         0.00000000      0.00000000
         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
        22.20738322
         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
         1.00000000
  
  
         0.00000000
         0.00000000      0.00000000      0.00000000
         0.00000000
         0.00000000
         0.00000000
  
  
    F  
  
 
 
       133 
         2 
  
   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
    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
    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
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    H    2
    H    2
    H    2
    H    2
   
  
  
   type
   atomspertype
   element
   mass
   valence
   pseudopotential
   
     129Si     28.08500000      4.00000000  PAW_PBE Si 05Jan2001                  
       4H       1.00000000      1.00000000  PAW_PBE H 15Jun2001                   
   
  
 
 
  
   
          15.36108000       0.00000000       0.00000000 
           0.00000000      15.36108000       0.00000000 
           0.00000000       0.00000000      20.86192000 
   
      4922.63661360 
   
           0.06509959       0.00000000       0.00000000 
           0.00000000       0.06509959       0.00000000 
           0.00000000       0.00000000       0.04793423 
   
  
  
          0.06393382       0.13072863       0.60050330 
          0.18753452       0.12508260       0.40299708 
          0.06253452       0.12508260       0.33720303 
          0.19056033       0.13330861       0.66759619 
          0.06256040       0.00037923       0.53647494 
          0.18753452       0.00008260       0.46802969 
          0.06253452       0.00008260       0.27136022 
          0.12993124       0.00411509       0.70602717 
          0.06505565       0.37468049       0.60412710 
          0.18753452       0.37508260       0.40299708 
          0.06253452       0.37508260       0.33720303 
          0.19381437       0.36614528       0.66817812 
          0.06274416       0.25326916       0.53370460 
          0.18753452       0.25008260       0.46802969 
          0.06253452       0.25008260       0.27136022 
          0.22901750       0.24897212       0.73798905 
          0.06284784       0.62364919       0.60197626 
          0.18753452       0.62508260       0.40299708 
          0.06253452       0.62508260       0.33720303 
          0.19183982       0.62300285       0.66455899 
          0.06283062       0.49851888       0.53627702 
          0.18753452       0.50008260       0.46802969 
          0.06253452       0.50008260       0.27136022 
          0.25730852       0.49568122       0.70097717 
          0.06213620       0.86868358       0.59834732 
          0.18753452       0.87508260       0.40299708 
          0.06253452       0.87508260       0.33720303 
          0.18716826       0.87543840       0.66416486 
          0.06247682       0.74577660       0.53290840 
          0.18753452       0.75008260       0.46802969 
          0.06253452       0.75008260       0.27136022 
          0.25669810       0.74998455       0.70121349 
          0.31140625       0.11946405       0.59866219 
          0.43753452       0.12508260       0.40299708 
          0.31253452       0.12508260       0.33720303 
          0.43831368       0.12458093       0.66305728 
          0.31233184       0.00079656       0.53010551 
          0.43753452       0.00008260       0.46802969 
          0.31253452       0.00008260       0.27136022 
          0.49958111       0.99650149       0.70438680 
          0.31276172       0.37430941       0.59453782 
          0.43753452       0.37508260       0.40299708 
          0.31253452       0.37508260       0.33720303 
          0.43303101       0.38360974       0.66671357 
          0.31209634       0.24626228       0.53321813 
          0.43753452       0.25008260       0.46802969 
          0.31253452       0.25008260       0.27136022 
          0.37431332       0.25270472       0.70196929 
          0.31594141       0.62625937       0.59375748 
          0.43753452       0.62508260       0.40299708 
          0.31253452       0.62508260       0.33720303 
          0.43032590       0.62348037       0.66845954 
          0.31275005       0.50007118       0.53074639 
          0.43753452       0.50008260       0.46802969 
          0.31253452       0.50008260       0.27136022 
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          0.43753452       0.87508260       0.40299708 
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          0.31253452       0.75008260       0.27136022 
          0.40133344       0.74807427       0.73348789 
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          0.68753452       0.12508260       0.40299708 
          0.56253452       0.12508260       0.33720303 
          0.68312785       0.11606508       0.66783456 
          0.56252730       0.00019590       0.53605889 
          0.68753452       0.00008260       0.46802969 
          0.56253452       0.00008260       0.27136022 
          0.64483469       0.00027360       0.73787318 
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          0.68753452       0.37508260       0.40299708 
          0.56253452       0.37508260       0.33720303 
          0.69293610       0.38337427       0.66572990 
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          0.68753452       0.25008260       0.46802969 
          0.56253452       0.25008260       0.27136022 
          0.73899450       0.24850531       0.70284860 
          0.56089899       0.62434446       0.60571668 
          0.68753452       0.62508260       0.40299708 
          0.56253452       0.62508260       0.33720303 
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          0.56197372       0.86990264       0.59964855 
          0.68753452       0.87508260       0.40299708 
          0.56253452       0.87508260       0.33720303 
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          0.56248962       0.74566576       0.53440351 
          0.68753452       0.75008260       0.46802969 
          0.56253452       0.75008260       0.27136022 
          0.73447880       0.75109434       0.70867234 
          0.81236388       0.11959009       0.60332454 
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          0.93753452       0.37508260       0.40299708 
          0.81253452       0.37508260       0.33720303 
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          0.93753452       0.25008260       0.46802969 
          0.81253452       0.25008260       0.27136022 
          0.88741690       0.24640083       0.71706103 
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          0.93753452       0.62508260       0.40299708 
          0.81253452       0.62508260       0.33720303 
          0.93294868       0.62621406       0.66341812 
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          0.93753452       0.50008260       0.46802969 
          0.81253452       0.50008260       0.27136022 
          0.86693980       0.49854012       0.69942226 
          0.81189765       0.88055154       0.60349998 
          0.93753452       0.87508260       0.40299708 
          0.81253452       0.87508260       0.33720303 
          0.94140810       0.88117102       0.66756309 
          0.81246504       0.75642004       0.53371934 
          0.93753452       0.75008260       0.46802969 
          0.81253452       0.75008260       0.27136022 
          0.88302585       0.75352032       0.70995972 
          0.75567154       0.75620808       0.91459721 
          0.78750968       0.66623285       0.90823255 
          0.66408336       0.76063952       0.89085419 
          0.81943235       0.81260859       0.87954288 
          0.75329860       0.78747520       0.98325627 
  
  
     T  T  T 
     F  F  F 
     F  F  F 
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         -3.00000000       0.00000000       0.00010000       0.00010000 
  
 
 
  
      12.77   35.40
      14.37   37.16
   
        115.70992877 
      25554.74999093 
     -38117.05696583 
      -1214.39618661 
      11376.50626006 
      -9107.00841578 
          0.01354548 
       -424.15756996 
      13344.57217335 
       1528.93276041 
       1528.91921493 
       1528.92824525 
   
  
  
      16.77   31.55
      16.78   31.59
   
       -495.35899485 
       -495.36483848 
       -495.36094273 
   
  
  
      20.14   33.70
      20.16   33.79
   
       -665.53923881 
       -665.40738664 
       -665.49528809 
   
  
  
      20.44   24.77
      20.44   24.77
   
       -674.30845271 
       -674.17648490 
       -674.26446344 
   
  
  
      11.39   22.22
      11.62   25.57
   
       -674.53588462 
       -674.40244537 
       -674.49140487 
   
  
  
      16.53   27.67
      18.93   31.86
   
       -660.94299588 
       -660.85483748 
       -660.91360975 
   
  
  
      10.79   16.46
      12.22   19.50
   
       -657.30829920 
       -657.42803777 
       -657.34821206 
   
  
  
      12.69   20.67
      15.31   28.87
   
       -657.40289420 
       -657.36341332 
       -657.38973391 
   
  
  
      10.95   32.83
      13.91   40.23
   
       -657.13137345 
       -657.17783804 
       -657.14686165 
   
  
  
       9.45   16.47
      11.64   22.66
   
       -657.07562963 
       -657.12040566 
       -657.09055497 
   
  
  
      20.57   36.40
      21.84   40.47
   
       -657.05480850 
       -657.03873831 
       -657.04945177 
   
  
  
       9.60   19.49
      11.19   22.72
   
       -657.05705511 
       -657.07317788 
       -657.06242937 
   
  
  
      14.79   23.71
      16.12   27.31
   
       -657.05228894 
       -657.06532115 
       -657.05663301 
   
  
  
      16.78   36.91
      19.57   43.11
   
       -657.05056967 
       -657.05277187 
       -657.05130374 
   
  
  
       8.75   19.05
      10.32   21.32
   
       -657.05072233 
       -657.06077116 
       -657.05407194