vasp 
  6.2.1  
  16May21 (build Apr 11 2022 11:03:26) complex                          parallel 
  Lin64 
  2023 09 08 
  10:26:25 
 
 
  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 
          0.50000000 
  
 
 
  
   No title
    F  
  
  
   normal
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         0.00010000
       38
       10
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       -1
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        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  
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     F  
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     F  
   
   
     F  
     F  
   
   
       180
        -5
         2
        400.00000000
    
      T  
      F  
           0.00000000
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          4
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          0.40000000
          1.00000000
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          4
      F  
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          1
          5
    
   
   
     F  
     F  
         0
          1.00000000
       -100.00000000   -100.00000000   -100.00000000
          0.00000000
   
  
  
       64
       96
      160
      128
      192
      320
    F  
  
  
        0
       -1
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        2
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        0
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        -3.00000000
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         0.00010000
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        1
        1
      256
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        2
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        0
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      301
        10.00000000
       -10.00000000
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        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
         0.00000000
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        1
        1
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    F  
    F  
    F  
        0
        0
    F  
         0.00000000
         0.00000000
        0
  
  
    F  
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         0.12340000
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        0
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    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  
  
 
 
       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 
          0.06537844       0.70009183       0.44010543 
          0.07790091       0.96768556       0.23781772 
          0.89582670       0.62785635       0.38781189 
          0.05476985       0.86347087       0.19650837 
          0.94604318       0.61756608       0.10185422 
          0.31717539       0.56594329       0.81532645 
          0.00569043       0.27224816       0.93687172 
          0.17407239       0.05542734       0.48801013 
          0.99730297       0.94843054       0.30414780 
          0.76652670       0.78935574       0.78407171 
          0.61417770       0.92559722       0.56958481 
          0.67919260       0.66596509       0.18248139 
          0.86433204       0.64255940       0.93110362 
          0.45827421       0.70815781       0.99851593 
          0.41395925       0.44754028       0.58684538 
          0.79729911       0.08699425       0.62655106 
          0.42715943       0.62524949       0.45405561 
          0.93609821       0.00693847       0.61517036 
          0.09782746       0.53882703       0.02912248 
          0.17547335       0.00073867       0.62273732 
          0.55989393       0.57902561       0.79825806 
          0.74674458       0.73892291       0.87308109 
          0.18527920       0.97226674       0.28811656 
          0.72688667       0.64495204       0.39510765 
          0.94575721       0.77305230       0.28790202 
          0.10846231       0.58463759       0.22191706 
          0.40981369       0.76218530       0.98900247 
          0.22434334       0.20289469       0.12510834 
          0.89100099       0.33426533       0.20090570 
          0.85016952       0.07359580       0.83272934 
          0.64893616       0.74450339       0.17501488 
          0.47366443       0.60560914       0.35112440 
          0.40858809       0.59110273       0.55155834 
          0.46899307       0.93497994       0.64647876 
          0.64669021       0.32216850       0.41188895 
          0.85988937       0.91434175       0.68393833 
          0.95135749       0.42889007       0.91123916 
          0.52503112       0.01772040       0.37516515 
          0.07653643       0.58712442       0.50175904 
          0.26469609       0.39738859       0.38550425 
          0.03038415       0.07722414       0.26769379 
          0.71953917       0.65262692       0.99518388 
          0.30299185       0.30311759       0.84184093 
          0.59802080       0.60817438       0.14558062 
          0.49180528       0.47878854       0.01274545 
          0.18742978       0.69118385       0.92928820 
          0.93874683       0.28731016       0.77433189 
          0.41365498       0.95513749       0.76123311 
          0.28455425       0.36172691       0.06667367 
          0.98646178       0.56569241       0.20607717 
          0.66456234       0.68960577       0.68672212 
          0.04174224       0.87041202       0.99126811 
          0.37457610       0.75247433       0.10043315 
          0.87359524       0.02100189       0.77099533 
          0.22146397       0.87938490       0.44153295 
          0.61802765       0.83289613       0.36404079 
          0.62179433       0.57528928       0.12988139 
          0.13503933       0.62274113       0.40064629 
          0.18821088       0.50622316       0.87631224 
          0.44739974       0.98328257       0.31703381 
          0.11173739       0.13949029       0.91813092 
          0.90252341       0.90082908       0.37925819 
          0.93431285       0.16859061       0.17504846 
          0.50689548       0.83593155       0.49162868 
          0.45805403       0.52125607       0.25123851 
          0.29660996       0.34151120       0.20354842 
          0.22420345       0.60843621       0.54162294 
          0.03780784       0.42922849       0.23182795 
          0.22158464       0.44572694       0.09030700 
          0.93723403       0.44278688       0.48417939 
          0.51416648       0.93305404       0.67770188 
          0.35856534       0.32077722       0.75345950 
          0.84104845       0.77887198       0.52245410 
          0.74074612       0.22840063       0.09305003 
          0.99444453       0.96113061       0.27543093 
          0.47597242       0.95872903       0.62018268 
          0.98438358       0.20851657       0.25102382 
          0.24384669       0.50119392       0.29992504 
          0.00687147       0.70979555       0.31188193 
          0.86048409       0.17068984       0.78059856 
          0.98712485       0.74892380       0.45785165 
          0.58161302       0.56333198       0.55925182 
          0.16349538       0.86040297       0.43970566 
          0.43117333       0.80217783       0.13363161 
          0.31987423       0.01453207       0.31569240 
          0.79326030       0.29076900       0.17105367 
          0.90462049       0.84328839       0.74188597 
          0.33680136       0.71004637       0.44980168 
          0.92417942       0.19970830       0.78272140 
          0.72641777       0.34520761       0.01191258 
          0.12623922       0.12687939       0.09683272 
          0.00480187       0.92400743       0.00666549 
          0.47127987       0.73320163       0.86283275 
          0.12729840       0.88937693       0.28650421 
          0.77426052       0.63657555       0.40129243 
          0.37858668       0.75533744       0.80325644 
          0.37367851       0.06940223       0.81503813 
          0.12396765       0.38599232       0.90000804 
          0.12689747       0.76925006       0.24257054 
          0.66228357       0.13484811       0.15216090 
          0.39153760       0.40809561       0.25290793 
          0.75066979       0.48272109       0.58642150 
          0.73723012       0.76929256       0.30484373 
          0.53444755       0.02476112       0.66437682 
          0.65159798       0.14209694       0.45714571 
          0.59888571       0.06571114       0.49620954 
          0.75988641       0.22121257       0.01103123 
          0.15469424       0.77625899       0.91419845 
          0.80439109       0.48833733       0.94153826 
          0.89092479       0.06517261       0.53171492 
          0.53171900       0.00727708       0.25839130 
          0.78637795       0.80079021       0.36944580 
          0.54886293       0.85200090       0.73447865 
          0.80543106       0.57343969       0.41161817 
          0.43845803       0.25500724       0.16379110 
          0.83274589       0.28295612       0.95023405 
          0.22340971       0.58782376       0.08175697 
          0.75571659       0.35896485       0.98966878 
          0.04334243       0.84473397       0.31825690 
          0.46707569       0.58284869       0.46488202 
          0.22201685       0.76987536       0.70132252 
          0.54293461       0.48460888       0.72927908 
          0.34976592       0.08073338       0.35181657 
          0.87898702       0.15929883       0.11289471 
          0.98551319       0.80147898       0.70961134 
          0.41816296       0.36969291       0.67752817 
          0.08672160       0.11203127       0.88052031 
          0.43439559       0.27383075       0.42175337 
          0.96858834       0.74200280       0.21100899 
          0.26227354       0.85630458       0.66801662 
          0.57465672       0.70689613       0.17447934 
          0.61286038       0.46485391       0.71609206 
          0.82647728       0.05231274       0.93962391 
          0.30287814       0.03922811       0.39993025 
          0.42788371       0.13178709       0.47090414 
          0.43402706       0.37788679       0.42835184 
          0.40006279       0.83300817       0.29611127 
          0.63437946       0.40482683       0.70739902 
          0.91076084       0.33914698       0.93710069 
          0.13153448       0.79972589       0.53046326 
          0.72083281       0.72174273       0.97131848 
          0.35165159       0.81540898       0.60804474 
          0.63152579       0.30245588       0.00261194 
          0.42063598       0.17758792       0.64415895 
          0.15598886       0.05559885       0.74691489 
          0.51381976       0.55251817       0.63253069 
          0.60822424       0.46581779       0.77184622 
          0.72549205       0.59941691       0.29380095 
          0.18441448       0.25301482       0.34758655 
          0.07614476       0.00519659       0.88515819 
          0.00197798       0.90784241       0.33667550 
          0.58249515       0.09867873       0.40600983 
          0.80522734       0.95399359       0.18562628 
          0.54937883       0.50993867       0.73619602 
          0.07334884       0.01571773       0.72064276 
          0.64109290       0.43017761       0.87627416 
          0.26147389       0.80056745       0.74900435 
          0.56388046       0.44263092       0.54719480 
          0.34671478       0.15187407       0.85447926 
  
  
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