vasp 
  6.2.1  
  16May21 (build Apr 11 2022 11:03:26) complex                          parallel 
  Lin64 
  2023 09 07 
  20:31:57 
 
 
  No title
       0
  Normal
  Normal (blocked Davidson)
   F  
       1
       2
       1
     180
       2
      -1
        0.00010000
       -0.02000000
       0
       2
       1
      400.00000000
        1.11000000      1.22000000      0.73000000      1.18000000      0.77000000      0.32000000
  Auto
       1
        0.20000000
       1
   F  
   F  
       1
 
 
  
   
    
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       7848.63264950 
    
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          2        1        1 
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          0.50000000      -0.00000000       0.00000000 
  
  
          0.50000000 
          0.50000000 
  
 
 
  
   No title
    F  
  
  
   normal
       400.00000000
       644.87300000
         0.00010000
       38
       10
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       -1
       -1
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        0
        0
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         1
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     T  
     T  
   
   
     T  
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      -100
         2
     F  
   
   
         0
         2
         1
   
   
         1
     F  
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         -1.00000000
     F  
          0.00000000      0.00000000      1.00000000
     F  
          0.00000000      0.00000000      0.00000000
     F  
   
   
     F  
     F  
   
   
       180
        -5
         2
        400.00000000
    
      T  
      F  
           0.00000000
           0.00000004
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          4
           0.40000000
    
   
   
          0.40000000
          1.00000000
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          1.60000000
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          4
      F  
        -45
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          1
          1
          5
    
   
   
     F  
     F  
         0
          1.00000000
       -100.00000000   -100.00000000   -100.00000000
          0.00000000
   
  
  
       64
       96
      160
      128
      192
      320
    F  
  
  
        0
       -1
        0
        2
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        0
         0.50000000
        -3.00000000
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         0.00010000
         0.00010000
        1
        1
      256
        16.00000000
  
  
        2
         0.00001000
  
  
        0
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      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
  
  
        2
        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  
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        0
        0
         0.00000000
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        1
        1
        1
    F  
    F  
    F  
        0
        0
    F  
         0.00000000
         0.00000000
        0
  
  
    F  
        -0.84910000
         0.12340000
         1.00000000
         0.00000000
  
  
        0
        21.11739726
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    F  
    F  
    F  
    F  
        0
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        -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  
  
 
 
       223 
         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
    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                  
      24C      12.01100000      4.00000000  PAW_PBE C 08Apr2002                   
      74H       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 
   
  
  
          0.35282294       0.01342142       0.32925451 
          0.04032294       0.95092142       0.32925451 
          0.91532294       0.82592142       0.24570759 
          0.19657294       0.98217142       0.28748105 
          0.66532294       0.57592142       0.24570759 
          0.97782294       0.63842142       0.24570759 
          0.94657294       0.73217142       0.28748105 
          0.82157294       0.60717142       0.20393413 
          0.72782294       0.38842142       0.24570759 
          0.69657294       0.48217142       0.28748105 
          0.29032294       0.20092142       0.32925451 
          0.16532294       0.07592142       0.24570759 
          0.47782294       0.13842142       0.24570759 
          0.32157294       0.10717142       0.20393413 
          0.85282294       0.01342142       0.24570759 
          0.38407294       0.91967142       0.20393413 
          0.60282294       0.76342142       0.24570759 
          0.00907294       0.54467142       0.28748105 
          0.32157294       0.60717142       0.28748105 
          0.10282294       0.26342142       0.24570759 
          0.07157294       0.35717142       0.28748105 
          0.94657294       0.23217142       0.20393413 
          0.00907294       0.04467142       0.20393413 
          0.88407294       0.91967142       0.28748105 
          0.63407294       0.66967142       0.28748105 
          0.38407294       0.41967142       0.28748105 
          0.25907294       0.29467142       0.20393413 
          0.13407294       0.16967142       0.28748105 
          0.22782294       0.88842142       0.24570759 
          0.10282294       0.76342142       0.32925451 
          0.07157294       0.85717142       0.20393413 
          0.79032294       0.70092142       0.32925451 
          0.85282294       0.51342142       0.32925451 
          0.54032294       0.45092142       0.32925451 
          0.41532294       0.32592142       0.24570759 
          0.60282294       0.26342142       0.32925451 
          0.57157294       0.35717142       0.20393413 
          0.44657294       0.23217142       0.28748105 
          0.54032294       0.95092142       0.24570759 
          0.50907294       0.04467142       0.28748105 
          0.72782294       0.88842142       0.32925451 
          0.69657294       0.98217142       0.20393413 
          0.41532294       0.82592142       0.32925451 
          0.29032294       0.70092142       0.24570759 
          0.25907294       0.79467142       0.28748105 
          0.57157294       0.85717142       0.28748105 
          0.47782294       0.63842142       0.32925451 
          0.44657294       0.73217142       0.20393413 
          0.16532294       0.57592142       0.32925451 
          0.13407294       0.66967142       0.20393413 
          0.04032294       0.45092142       0.24570759 
          0.35282294       0.51342142       0.24570759 
          0.22782294       0.38842142       0.32925451 
          0.19657294       0.48217142       0.20393413 
          0.91532294       0.32592142       0.32925451 
          0.88407294       0.41967142       0.20393413 
          0.79032294       0.20092142       0.24570759 
          0.75907294       0.29467142       0.28748105 
          0.97782294       0.13842142       0.32925451 
          0.66532294       0.07592142       0.32925451 
          0.63407294       0.16967142       0.20393413 
          0.82157294       0.10717142       0.28748105 
          0.75907294       0.79467142       0.20393413 
          0.50907294       0.54467142       0.20393413 
          0.18793291       0.72300263       0.58833768 
          0.22312845       0.87288491       0.34068677 
          0.05669879       0.40922391       0.56281125 
          0.95730816       0.80621437       0.29560829 
          0.21100754       0.66272363       0.21545375 
          0.03829185       0.08713050       0.40144850 
          0.52486340       0.39694434       0.90493323 
          0.00335731       0.89044943       0.57567823 
          0.26865338       0.63511791       0.94444982 
          0.12481700       0.51080704       0.14405826 
          0.33912584       0.98593261       0.73510550 
          0.48352136       0.76312765       0.27502794 
          0.68448160       0.48883801       0.95464026 
          0.59134018       0.99627623       0.14522340 
          0.71980187       0.60122896       0.14558034 
          0.84676186       0.07633281       0.69094485 
          0.35783859       0.75784453       0.53531815 
          0.91077395       0.09248527       0.67750034 
          0.11838681       0.68292490       0.97218378 
          0.26244149       0.55988055       0.66241243 
          0.81600290       0.54518663       0.84943959 
          0.05221588       0.75252361       0.92101144 
          0.34762470       0.07709338       0.07936242 
          0.31522020       0.95499277       0.50297252 
          0.30119475       0.50701885       0.13071273 
          0.71345875       0.23640421       0.67324050 
          0.72266443       0.63878414       0.09043560 
          0.21228411       0.15209974       0.14622939 
          0.83828828       0.56767408       0.12166629 
          0.05036625       0.13351294       0.88638775 
          0.69694616       0.76219729       0.28280191 
          0.54041559       0.52738537       0.44460558 
          0.72628153       0.63056848       0.62526361 
          0.79280201       0.12814701       0.79537849 
          0.68768052       0.30248624       0.49621281 
          0.66771797       0.84726403       0.09974621 
          0.39285315       0.26991806       0.42588141 
          0.67091652       0.95131534       0.46322762 
          0.30175153       0.81940999       0.51226423 
          0.57679116       0.47041897       0.58243804 
          0.24990334       0.20856839       0.33948006 
          0.82494889       0.72982830       0.12969308 
          0.73666005       0.50860113       0.93721430 
          0.64800464       0.77994887       0.23718301 
          0.65733026       0.38594064       0.12714956 
          0.14525502       0.58467378       0.89668105 
          0.30311600       0.21708833       0.25889537 
          0.89780117       0.82807047       0.37349794 
          0.11181747       0.72806223       0.65796798 
          0.48513529       0.39747829       0.36014757 
          0.49317302       0.45151380       0.81694426 
          0.37080701       0.86413207       0.23316147 
          0.68299245       0.49168330       0.19046108 
          0.99377955       0.00372973       0.91144142 
          0.31846032       0.79632379       0.52398148 
          0.63967466       0.84837061       0.45316660 
          0.51645154       0.81094858       0.33159435 
          0.49091236       0.69676570       0.40099989 
          0.49591816       0.50117421       0.83202364 
          0.91443795       0.94897198       0.40531365 
          0.18830745       0.15944928       0.04413324 
          0.92184504       0.33032762       0.66370399 
          0.18116225       0.17790489       0.28147670 
          0.87875064       0.02763059       0.48538185 
          0.92250993       0.90167778       0.62731760 
          0.34084071       0.39029812       0.31675643 
          0.33825790       0.88304863       0.62154641 
          0.72694111       0.45804281       0.42969444 
          0.50769544       0.66100351       0.20453567 
          0.18589021       0.32795699       0.65567931 
          0.49094265       0.71779621       0.55899128 
          0.41986090       0.05882870       0.45198960 
          0.74752828       0.25628999       0.59603137 
          0.61539819       0.46748594       0.46943739 
          0.89198990       0.44178496       0.54804775 
          0.36877645       0.29017991       0.76859482 
          0.45360281       0.72104953       0.43754783 
          0.24255279       0.61263898       0.48698555 
          0.04972798       0.29053093       0.49902038 
          0.96797775       0.15207758       0.92182636 
          0.53131916       0.17802210       0.29470674 
          0.60474368       0.44559975       0.81040474 
          0.15756163       0.82313910       0.44426844 
          0.50715442       0.92988558       0.19553379 
          0.42223762       0.11800043       0.50602829 
          0.84737669       0.91502233       0.63986607 
          0.23414233       0.03218502       0.31495743 
          0.94237509       0.96781669       0.69128785 
          0.62550060       0.25551765       0.19122773 
          0.48164348       0.17431278       0.22811196 
          0.18564021       0.87582616       0.30278683 
          0.19352879       0.68782771       0.09082203 
          0.07395008       0.78205950       0.57140162 
          0.53740590       0.93333797       0.38325179 
          0.21198070       0.68544924       0.48848624 
          0.89255005       0.98222510       0.46820152 
          0.89779852       0.95151409       0.96070291 
          0.64111508       0.49547051       0.21410124 
          0.29429696       0.78913066       0.34896167 
          0.75210454       0.29215243       0.27136182 
          0.35170397       0.45271258       0.36059826 
          0.43167199       0.01557323       0.66260147 
          0.53455422       0.08392991       0.91390397 
          0.09682002       0.31716534       0.55926023 
          0.58814032       0.11293046       0.63728329 
          0.78462079       0.30490882       0.58029044 
          0.59200070       0.53735893       0.30729080 
          0.45586952       0.96772505       0.04395165 
          0.12223432       0.71863285       0.06050362 
          0.21368855       0.30952611       0.60899403 
          0.88975521       0.75521333       0.44696956 
          0.93578018       0.74185542       0.55057514 
          0.64313298       0.69746781       0.88372759 
          0.56912850       0.39408256       0.34123032 
          0.49741518       0.04496760       0.40869711 
          0.58027739       0.94096663       0.25350555 
          0.39751498       0.96924761       0.25496824 
          0.67686087       0.26329461       0.21116595 
          0.63447239       0.67855411       0.30546532 
          0.07991812       0.74631621       0.28658690 
          0.28530607       0.54670295       0.40929935 
          0.41031623       0.28754431       0.88024436 
          0.23010236       0.40728833       0.05985014 
          0.52242246       0.77940990       0.09600077 
          0.06415938       0.26681757       0.77363064 
          0.32332013       0.98584971       0.84305755 
          0.19603822       0.94937018       0.11749337 
          0.87466254       0.05064696       0.04506215 
          0.62536204       0.64042139       0.30064448 
          0.78338346       0.06573046       0.28775791 
          0.93482245       0.51324766       0.80814915 
          0.53481906       0.46771657       0.77960322 
          0.26224806       0.19458860       0.15696565 
          0.92121936       0.29927005       0.35482913 
          0.41974182       0.27849870       0.73195028 
          0.41582675       0.50936827       0.60654896 
          0.37920779       0.00449329       0.48604192 
          0.95832187       0.10465816       0.03483491 
          0.75883453       0.12007315       0.06883834 
          0.80239219       0.29423335       0.69753465 
          0.99810580       0.82918300       0.10218149 
          0.33265388       0.82974356       0.76652828 
          0.85783482       0.19362013       0.12659588 
          0.41661071       0.85398529       0.80722225 
          0.14460527       0.16807185       0.93497908 
          0.43762392       0.17417688       0.53576339 
          0.35937020       0.42677536       0.01598576 
          0.55780411       0.38017265       0.48582682 
          0.98423821       0.24625297       0.44395512 
          0.24173186       0.66714299       0.85789508 
          0.17646109       0.03075028       0.43583512 
          0.27319783       0.94297346       0.49871362 
          0.73606287       0.00957063       0.37994630 
          0.76729546       0.59862865       0.71417926 
          0.15905191       0.13914688       0.95998772 
          0.67665839       0.47519749       0.10127699 
          0.32196128       0.80458287       0.89779928 
          0.61568884       0.47936872       0.71537547 
          0.93949833       0.49858751       0.52697784 
  
  
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