vasp 
  6.2.1  
  16May21 (build Apr 11 2022 11:03:26) complex                          parallel 
  Lin64 
  2023 08 24 
  12:51:45 
 
 
  No title
       0
  Normal
  Normal (blocked Davidson)
   F  
       1
       2
       1
     180
       2
      -1
        0.00010000
       -0.02000000
       0
       2
       1
      400.00000000
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  Auto
       1
        0.20000000
       1
   F  
   F  
       1
 
 
  
   
    
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       7848.63264950 
    
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           0.98304789       0.83936463       0.41065485 
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           0.65779219       0.61614417       0.69527339 
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          2        1        1 
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          0.50000000 
          0.50000000 
  
 
 
  
   No title
    F  
  
  
   normal
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         0.00010000
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       10
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       -1
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     T  
     T  
   
   
     T  
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     F  
   
   
         0
         2
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         1
     F  
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         -1.00000000
     F  
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     F  
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     F  
   
   
     F  
     F  
   
   
       180
        -5
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      T  
      F  
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          4
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          4
      F  
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     F  
     F  
         0
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       64
       96
      160
      128
      192
      320
    F  
  
  
        0
       -1
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         0.00010000
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        1
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    F  
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    F  
    F  
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        1
        4
       -1
    T  
    F  
    F  
    F  
    F  
    F  
  
  
        3
       -1
    F  
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    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
        20.56410301
         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
      180
        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  
  
 
 
       229 
         6 
  
   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
    Ge   2
    Ge   2
    Ge   2
    Ge   2
    Ge   2
    Ge   2
    Ge   2
    Ge   2
    Ge   2
    Ge   2
    Ge   2
    Ge   2
    Ge   2
    Ge   2
    Ge   2
    Ge   2
    Ge   2
    Ge   2
    Ge   2
    Ge   2
    Ge   2
    Ge   2
    Ge   2
    Ge   2
    Ge   2
    Ge   2
    Ge   2
    Ge   2
    Ge   2
    Ge   2
    Ge   2
    Ge   2
    Ge   2
    Ge   2
    Ge   2
    Ge   2
    O    3
    O    3
    O    3
    O    3
    O    3
    O    3
    O    3
    O    3
    O    3
    O    3
    O    3
    O    3
    O    3
    O    3
    O    3
    O    3
    O    3
    O    3
    O    3
    O    3
    O    3
    O    3
    O    3
    O    3
    O    3
    O    3
    O    3
    O    3
    O    3
    O    3
    O    3
    O    3
    O    3
    O    3
    O    3
    O    3
    O    3
    Al   4
    Al   4
    Al   4
    Al   4
    Al   4
    Al   4
    Al   4
    Al   4
    Al   4
    Al   4
    Al   4
    Al   4
    Al   4
    Al   4
    Al   4
    Al   4
    Al   4
    Al   4
    Al   4
    Al   4
    Al   4
    Al   4
    Al   4
    Al   4
    C    5
    C    5
    C    5
    C    5
    C    5
    C    5
    C    5
    C    5
    C    5
    C    5
    C    5
    C    5
    C    5
    C    5
    C    5
    C    5
    C    5
    C    5
    C    5
    C    5
    C    5
    C    5
    C    5
    C    5
    C    5
    C    5
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
   
  
  
   type
   atomspertype
   element
   mass
   valence
   pseudopotential
   
      28Si     28.08500000      4.00000000  PAW_PBE Si 05Jan2001                  
      36Ge     72.61000000     14.00000000  PAW_PBE Ge_d 03Jul2007                
      37O      16.00000000      6.00000000  PAW_PBE O 08Apr2002                   
      24Al     26.98100000      3.00000000  PAW_PBE Al 04Jan2001                  
      26C      12.01100000      4.00000000  PAW_PBE C 08Apr2002                   
      78H       1.00000000      1.00000000  PAW_PBE H 15Jun2001                   
   
  
 
 
  
   
          12.47140000       0.00000000       0.00000000 
          -3.04885115      19.22970392       0.00000000 
           0.00000000       0.00000000      32.72700000 
   
      7848.63264950 
   
           0.08018346       0.01271301       0.00000000 
           0.00000000       0.05200288       0.00000000 
           0.00000000       0.00000000       0.03055581 
   
  
  
          0.35360986       0.01456922       0.33538995 
          0.04110986       0.95206922       0.33538995 
          0.91610986       0.82706922       0.25184303 
          0.19735986       0.98331922       0.29361649 
          0.66610986       0.57706922       0.25184303 
          0.97860986       0.63956922       0.25184303 
          0.94735986       0.73331922       0.29361649 
          0.82235986       0.60831922       0.21006957 
          0.72860986       0.38956922       0.25184303 
          0.69735986       0.48331922       0.29361649 
          0.29110986       0.20206922       0.33538995 
          0.16610986       0.07706922       0.25184303 
          0.47860986       0.13956922       0.25184303 
          0.32235986       0.10831922       0.21006957 
          0.85360986       0.01456922       0.25184303 
          0.38485986       0.92081922       0.21006957 
          0.60360986       0.76456922       0.25184303 
          0.00985986       0.54581922       0.29361649 
          0.32235986       0.60831922       0.29361649 
          0.10360986       0.26456922       0.25184303 
          0.07235986       0.35831922       0.29361649 
          0.94735986       0.23331922       0.21006957 
          0.00985986       0.04581922       0.21006957 
          0.88485986       0.92081922       0.29361649 
          0.63485986       0.67081922       0.29361649 
          0.38485986       0.42081922       0.29361649 
          0.25985986       0.29581922       0.21006957 
          0.13485986       0.17081922       0.29361649 
          0.22860986       0.88956922       0.25184303 
          0.10360986       0.76456922       0.33538995 
          0.07235986       0.85831922       0.21006957 
          0.79110986       0.70206922       0.33538995 
          0.85360986       0.51456922       0.33538995 
          0.54110986       0.45206922       0.33538995 
          0.41610986       0.32706922       0.25184303 
          0.60360986       0.26456922       0.33538995 
          0.57235986       0.35831922       0.21006957 
          0.44735986       0.23331922       0.29361649 
          0.54110986       0.95206922       0.25184303 
          0.50985986       0.04581922       0.29361649 
          0.72860986       0.88956922       0.33538995 
          0.69735986       0.98331922       0.21006957 
          0.41610986       0.82706922       0.33538995 
          0.29110986       0.70206922       0.25184303 
          0.25985986       0.79581922       0.29361649 
          0.57235986       0.85831922       0.29361649 
          0.47860986       0.63956922       0.33538995 
          0.44735986       0.73331922       0.21006957 
          0.16610986       0.57706922       0.33538995 
          0.13485986       0.67081922       0.21006957 
          0.04110986       0.45206922       0.25184303 
          0.35360986       0.51456922       0.25184303 
          0.22860986       0.38956922       0.33538995 
          0.19735986       0.48331922       0.21006957 
          0.91610986       0.32706922       0.33538995 
          0.88485986       0.42081922       0.21006957 
          0.79110986       0.20206922       0.25184303 
          0.75985986       0.29581922       0.29361649 
          0.97860986       0.13956922       0.33538995 
          0.66610986       0.07706922       0.33538995 
          0.63485986       0.17081922       0.21006957 
          0.82235986       0.10831922       0.29361649 
          0.75985986       0.79581922       0.21006957 
          0.50985986       0.54581922       0.21006957 
          0.84523850       0.88076769       0.42318558 
          0.89169466       0.01958998       0.44206529 
          0.75454965       0.13973858       0.38142633 
          0.93095404       0.23576698       0.34983602 
          0.97529222       0.13925115       0.39515343 
          0.74409768       0.39328966       0.37976641 
          0.91418064       0.49967916       0.38643131 
          0.94493414       0.36090067       0.39198800 
          0.77625029       0.59970126       0.35488627 
          0.88283825       0.75834584       0.40969834 
          0.99326639       0.64179727       0.40177189 
          0.00447364       0.88882165       0.36539715 
          0.44359384       0.72618837       0.35928263 
          0.67123436       0.80058267       0.38453497 
          0.58617381       0.65430566       0.38724043 
          0.41424564       0.96228055       0.36973146 
          0.57108722       0.06674045       0.38457406 
          0.67181619       0.97274211       0.35393009 
          0.39468576       0.19302254       0.36414975 
          0.54024757       0.32510349       0.37222543 
          0.59497709       0.21400127       0.38477272 
          0.40518223       0.47245002       0.42471661 
          0.53163207       0.54758956       0.34716147 
          0.63424361       0.50448794       0.41390250 
          0.11549687       0.28737601       0.41323649 
          0.23934738       0.42666730       0.38846851 
          0.15309445       0.54332435       0.38866851 
          0.19297593       0.67612555       0.35057170 
          0.35343367       0.61354013       0.40592314 
          0.10160451       0.79176634       0.39035625 
          0.21581080       0.92296427       0.40414605 
          0.32233891       0.79789301       0.38707472 
          0.05886160       0.03314145       0.35609582 
          0.20072998       0.17478191       0.37838546 
          0.29415097       0.05247989       0.37582947 
          0.33864095       0.29978325       0.40669362 
          0.57153705       0.59534822       0.62786877 
          0.87331100       0.19520927       0.39481167 
          0.85502202       0.41928383       0.41055480 
          0.91886672       0.68250827       0.43800584 
          0.85748788       0.94040468       0.46305907 
          0.55615694       0.73864418       0.39776293 
          0.76748852       0.79778077       0.42555682 
          0.55866846       0.97465941       0.38851900 
          0.63501019       0.14182259       0.41143200 
          0.46354789       0.25259920       0.40205903 
          0.61659172       0.40560790       0.39577793 
          0.53179654       0.48198833       0.45266180 
          0.64540076       0.57784504       0.38084505 
          0.31921037       0.38386822       0.42647142 
          0.28753101       0.52027859       0.40991776 
          0.31587381       0.62920632       0.46024622 
          0.30278438       0.70040197       0.38772332 
          0.22504544       0.83775967       0.41672825 
          0.32527247       0.98469398       0.41352487 
          0.16350222       0.08207143       0.38521608 
          0.21690144       0.23848211       0.42148575 
          0.98286163       0.09307330       0.44307099 
          0.00974040       0.32072424       0.43297259 
          0.02184466       0.56044050       0.41202438 
          0.98304789       0.83936463       0.41065485 
          0.53641171       0.50357657       0.51151996 
          0.65779219       0.61614417       0.69527339 
          0.55833065       0.61924901       0.66882300 
          0.83882571       0.24664012       0.44346807 
          0.82024566       0.41940301       0.46931129 
          0.99248998       0.71499020       0.49098304 
          0.81048838       0.93420030       0.52017088 
          0.49178282       0.74599051       0.45117047 
          0.72109028       0.77338185       0.48217751 
          0.57322983       0.92769170       0.44019439 
          0.64971302       0.11892673       0.46971709 
          0.47650300       0.22190133       0.45943867 
          0.56821984       0.37857812       0.45597858 
          0.78015675       0.62352450       0.45547240 
          0.29978766       0.36976011       0.48661136 
          0.25107716       0.52519735       0.47260082 
          0.34664270       0.65419863       0.51836837 
          0.20872776       0.69095979       0.44292837 
          0.27411271       0.84188537       0.47565482 
          0.37854193       0.01763462       0.46744048 
          0.13803630       0.05457907       0.44395448 
          0.22482834       0.19835296       0.47647738 
          0.96368733       0.14292933       0.49473881 
          0.02631765       0.34901065       0.49094076 
          0.01033721       0.54057519       0.47132604 
          0.02912724       0.87680984       0.46636694 
          0.61986698       0.50456652       0.52273371 
          0.50781097       0.55072328       0.52295252 
          0.48597543       0.45917934       0.52628028 
          0.67950185       0.56359243       0.69459338 
          0.64283386       0.62945986       0.72728378 
          0.72772455       0.65306954       0.68438581 
          0.53786971       0.67266669       0.66830868 
          0.48737764       0.58476652       0.68093544 
          0.63529079       0.62385770       0.61628070 
          0.87624668       0.28079036       0.46799883 
          0.76987687       0.27081153       0.43247724 
          0.80594696       0.20050638       0.46160495 
          0.88809173       0.43279530       0.49020112 
          0.76761685       0.45914077       0.47388752 
          0.77490339       0.36952703       0.47955877 
          0.06665038       0.75357467       0.49135420 
          0.93303171       0.73653803       0.51013873 
          0.01102619       0.66956931       0.50816704 
          0.86017016       0.97683104       0.53701122 
          0.72540517       0.94224483       0.52334103 
          0.81851968       0.88518779       0.53556553 
          0.40442446       0.74795917       0.45046448 
          0.50630034       0.70225396       0.47044887 
          0.52517670       0.79268045       0.46827430 
          0.79721218       0.77516319       0.49951594 
          0.67729498       0.81257086       0.49573009 
          0.67340074       0.72216089       0.48788018 
          0.60749913       0.96682329       0.46289574 
          0.49881404       0.89842490       0.45318343 
          0.63107827       0.89116979       0.43608927 
          0.66759716       0.16198470       0.49156881 
          0.57616533       0.08607457       0.48109590 
          0.71591178       0.08739979       0.47155000 
          0.42683345       0.24541432       0.48145691 
          0.45052988       0.16548664       0.46219226 
          0.56012360       0.23199580       0.47091825 
          0.60782027       0.39750039       0.48477164 
          0.49071394       0.34737616       0.46429131 
          0.61953243       0.33982732       0.44660950 
          0.77073112       0.62556727       0.48889677 
          0.70446990       0.63875419       0.44338866 
          0.78038448       0.56878170       0.44769039 
          0.32478405       0.41724632       0.50430661 
          0.21790165       0.34839174       0.49666593 
          0.35195483       0.33240365       0.49655117 
          0.19270669       0.54787446       0.49139000 
          0.20197777       0.47440839       0.46484585 
          0.31510766       0.51305560       0.49305094 
          0.26642219       0.64566390       0.53324474 
          0.39758295       0.62292261       0.53527429 
          0.38041567       0.70920591       0.52249130 
          0.14610393       0.69862978       0.42001109 
          0.15650516       0.64729525       0.45863979 
          0.21575871       0.73365022       0.46481211 
          0.35436719       0.82614516       0.47971347 
          0.28243340       0.89622569       0.48598825 
          0.22068911       0.81205798       0.49836641 
          0.40731641       0.07384332       0.46841360 
          0.31032101       0.00702208       0.48906020 
          0.44336624       0.99167038       0.47975509 
          0.10558054       0.05729680       0.47517808 
          0.13407790       0.99840637       0.43802771 
          0.22261189       0.07762745       0.45090165 
          0.24891003       0.24151260       0.49781626 
          0.14581394       0.17246967       0.48724934 
          0.28338649       0.16255484       0.48081057 
          0.99043619       0.19904432       0.49787800 
          0.87689191       0.13175016       0.50272582 
          0.00575615       0.11806598       0.51906025 
          0.07802338       0.39912029       0.49662481 
          0.95083485       0.34939883       0.50810584 
          0.06770831       0.30893275       0.50512404 
          0.05830167       0.58233151       0.48918571 
          0.92589460       0.54325488       0.47987350 
          0.02963310       0.49126985       0.48287491 
          0.02655029       0.93372862       0.46633659 
          0.96965380       0.85162638       0.48881502 
          0.10843486       0.87449805       0.48010702 
  
  
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         -3.00000000       0.00000000       0.00010000       0.00010000 
  
 
 
  
      24.83   24.89
      26.32   26.38
   
        773.09346045 
     503992.99766096 
    -595132.59835806 
       3289.00216446 
      85984.79816423 
    -100465.99103074 
          0.01731442 
      -4984.36261753 
     118427.16121518 
      11884.11797337 
      11884.10065895 
      11884.11220189 
   
  
  
      30.62   30.62
      30.62   30.62
   
       1238.61251935 
       1238.58460505 
       1238.60321458 
   
  
  
      33.06   33.06
      33.06   33.06
   
      -1110.98928297 
      -1111.02110507 
      -1110.99989033 
   
  
  
      31.98   31.97
      31.98   31.98
   
      -1342.83262486 
      -1342.91800104 
      -1342.86108358 
   
  
  
      35.39   35.39
      35.92   35.92
   
      -1354.61897757 
      -1354.70239093 
      -1354.64678202 
   
  
  
      35.10   35.10
      37.15   37.14
   
      -1211.35688894 
      -1211.34373516 
      -1211.35250435 
   
  
  
      32.42   32.42
      34.57   34.57
   
      -1209.49915177 
      -1209.52725563 
      -1209.50851972 
   
  
  
      33.29   33.29
      35.74   35.74
   
      -1207.39093447 
      -1207.36261110 
      -1207.38149335 
   
  
  
      32.34   32.33
      34.56   34.55
   
      -1206.48184083 
      -1206.48726794 
      -1206.48364986 
   
  
  
      33.58   33.57
      35.70   35.70
   
      -1206.09168132 
      -1206.05981372 
      -1206.08105879 
   
  
  
      33.92   33.92
      36.08   36.07
   
      -1205.82882275 
      -1205.83040421 
      -1205.82934990 
   
  
  
      33.63   33.63
      35.75   35.74
   
      -1205.80079875 
      -1205.79588817 
      -1205.79916189 
   
  
  
      30.98   30.97
      33.10   33.09
   
      -1205.79285096 
      -1205.78655153 
      -1205.79075115 
   
  
  
      31.25   31.25
      33.37   33.37
   
      -1205.78962310 
      -1205.78334007 
      -1205.78752876 
   
  
  
      32.43   32.42
      34.56   34.55
   
      -1205.78275644 
      -1205.77752945 
      -1205.78101411 
   
  
  
      32.24   32.24
      34.54   34.54
   
      -1205.78039082 
      -1205.77469289 
      -1205.77849151 
   
  
  
      42.48   42.49
      45.32   45.33
   
      -1205.78263804 
      -1205.77746581 
      -1205.78091397 
   
  
  
      77.94   78.02
      83.66   83.75
   
      -1205.78491971 
      -1205.78001179 
      -1205.78328374