vasp 
  6.2.1  
  16May21 (build Apr 11 2022 11:03:26) complex                          parallel 
  Lin64 
  2023 09 08 
  02:53:03 
 
 
  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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          0.00000000       0.00000000       0.00000000 
          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
        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  
          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
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          0.40000000
          1.00000000
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          1.00000000
    
          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
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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
        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  
        -1.00000000
        0
        0
         0.00000000
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         1.00000000
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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
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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 
          0.17064164       0.70519240       0.45011626 
          0.08922724       0.92788071       0.25848817 
          0.92995223       0.57971542       0.42757383 
          0.03332505       0.84789218       0.21842953 
          0.00184068       0.62761797       0.13095193 
          0.81232662       0.44855859       0.69762637 
          0.12166070       0.32277963       0.95957305 
          0.18126450       0.99680181       0.52440549 
          0.36162856       0.10844622       0.21152190 
          0.39286620       0.46382945       0.11368200 
          0.75590759       0.93899615       0.61506641 
          0.52115869       0.68025622       0.19363709 
          0.87971418       0.63958725       0.92254533 
          0.46428725       0.80830425       0.05491418 
          0.90432107       0.70134739       0.52345813 
          0.80153793       0.08594603       0.64108312 
          0.42379458       0.66606452       0.47317901 
          0.92718576       0.02625487       0.62566202 
          0.11127771       0.55175970       0.02188309 
          0.43599948       0.13686522       0.60295137 
          0.59979952       0.56529156       0.81032364 
          0.84935522       0.93172095       0.78006444 
          0.09465132       0.04330281       0.45630740 
          0.39293278       0.32270179       0.14561912 
          0.01075961       0.91033230       0.26671957 
          0.29262656       0.42431148       0.05764563 
          0.17475165       0.80041420       0.98064075 
          0.21405148       0.18662115       0.13224405 
          0.89742887       0.44155833       0.17646645 
          0.89660074       0.08382599       0.85219385 
          0.66193404       0.75376124       0.19982888 
          0.48093434       0.58046278       0.37527535 
          0.47413169       0.60275584       0.57050250 
          0.52818594       0.97125146       0.67667423 
          0.63221778       0.32383546       0.43202670 
          0.99586756       0.88137577       0.77764999 
          0.17475877       0.84988781       0.02902046 
          0.60870201       0.00660922       0.38877385 
          0.19079754       0.61891207       0.51798001 
          0.59026639       0.36642248       0.44444411 
          0.12666295       0.15789718       0.25543460 
          0.77140245       0.65788435       0.04536412 
          0.53038250       0.54281205       0.81076211 
          0.58064044       0.68758197       0.15394702 
          0.50052473       0.47936334       0.02789617 
          0.22337872       0.69807337       0.94873919 
          0.90772558       0.00494673       0.61919160 
          0.63111782       0.09415983       0.50817841 
          0.46218726       0.42982094       0.99478990 
          0.79005492       0.57067754       0.19349896 
          0.57918982       0.55643434       0.70462971 
          0.20500052       0.79858401       0.16831419 
          0.51028203       0.63149515       0.09582010 
          0.90312386       0.01460071       0.79548995 
          0.24455591       0.85466054       0.45633903 
          0.57229005       0.83565433       0.37744229 
          0.62029380       0.62868685       0.17435516 
          0.39479991       0.67706649       0.32244369 
          0.08491607       0.52490758       0.85890114 
          0.52644290       0.97670995       0.32865823 
          0.13762742       0.08366499       0.93334262 
          0.94757065       0.12918158       0.80812592 
          0.97372050       0.18156243       0.19661771 
          0.60647412       0.93690056       0.48780620 
          0.52319538       0.62375077       0.34395149 
          0.30474796       0.34856869       0.22691504 
          0.20608957       0.93839324       0.64377694 
          0.93872984       0.43140760       0.27717618 
          0.27960995       0.49152374       0.10958803 
          0.01292637       0.42202047       0.51970521 
          0.34080465       0.65036236       0.63357143 
          0.70222281       0.13375561       0.68951436 
          0.67061917       0.09131739       0.53710327 
          0.47212142       0.07789320       0.18085624 
          0.90296758       0.05179975       0.32705079 
          0.80078336       0.05531540       0.64503553 
          0.09665726       0.37303820       0.28165453 
          0.23663841       0.51770828       0.33652926 
          0.02874342       0.60701583       0.35101907 
          0.87575226       0.15520292       0.80810965 
          0.82464648       0.89501957       0.31386796 
          0.58930275       0.54438490       0.61609070 
          0.17343751       0.86574738       0.44365288 
          0.45957297       0.88571348       0.09766363 
          0.37768279       0.06379453       0.36017735 
          0.05415833       0.22838466       0.02533626 
          0.57412782       0.43738396       0.82238185 
          0.47977171       0.85441265       0.11347423 
          0.93526057       0.94951868       0.28529837 
          0.68405539       0.32358354       0.05769798 
          0.14206820       0.07097947       0.14528475 
          0.06209620       0.85425970       0.97979417 
          0.52722548       0.72726850       0.80386643 
          0.22407541       0.88997948       0.29929626 
          0.87199885       0.63197503       0.41428724 
          0.40440569       0.76183330       0.93316577 
          0.55266573       0.04203643       0.84220732 
          0.23959342       0.40678426       0.96652819 
          0.17895728       0.77501221       0.25869082 
          0.67965240       0.16797662       0.17751029 
          0.39167803       0.42116917       0.27236641 
          0.63908020       0.57671892       0.60408852 
          0.67978415       0.06093376       0.40799148 
          0.43645679       0.02436740       0.64247137 
          0.65378723       0.14042270       0.49863736 
          0.64382145       0.11327550       0.51062014 
          0.74434731       0.30462651       0.06408988 
          0.22057422       0.81863806       0.93608655 
          0.86521214       0.56396020       0.95010470 
          0.95500645       0.11458420       0.54699787 
          0.60106844       0.94980081       0.29175460 
          0.80886712       0.79315224       0.40491254 
          0.55964401       0.81865725       0.76387280 
          0.46841192       0.31225578       0.31552628 
          0.86435630       0.02070612       0.00882247 
          0.56443104       0.80501756       0.01021784 
          0.01803317       0.03661621       0.06743960 
          0.81332066       0.60628579       0.04176714 
          0.96548668       0.41357867       0.87888610 
          0.69680077       0.59510183       0.41145389 
          0.93797643       0.19794090       0.52704290 
          0.55873840       0.68427463       0.76369083 
          0.45942219       0.92243717       0.49631621 
          0.89432401       0.58546415       0.17854626 
          0.18554882       0.88361934       0.96446150 
          0.42891576       0.48279379       0.72230984 
          0.13896369       0.31988975       0.94995674 
          0.26603774       0.26271192       0.55308140 
          0.24733085       0.86593771       0.20125027 
          0.94202332       0.71481476       0.81861687 
          0.80954619       0.63695960       0.29700596 
          0.81280173       0.44511501       0.73665022 
          0.97278943       0.07651383       0.98593431 
          0.76590058       0.17762380       0.42373234 
          0.42676593       0.16157994       0.52491141 
          0.42362835       0.40594658       0.46510658 
          0.38905971       0.86728569       0.33451728 
          0.68486380       0.33320994       0.77574510 
          0.86848722       0.27987321       0.96185479 
          0.05144346       0.69684941       0.56271380 
          0.76037608       0.73527790       0.99804741 
          0.34771029       0.81719390       0.64101390 
          0.67909617       0.27685202       0.02766819 
          0.42887317       0.14011619       0.67926535 
          0.79835191       0.88707668       0.83033791 
          0.26902279       0.48917566       0.61642183 
          0.53446009       0.51875591       0.83012343 
          0.68079165       0.54806839       0.33486994 
          0.12678391       0.25978553       0.36058615 
          0.09181538       0.90543691       0.88635431 
          0.04920726       0.92907704       0.35203343 
          0.51562567       0.06670903       0.42197403 
          0.78608320       0.96652218       0.21911897 
          0.61350650       0.52637110       0.73290154 
          0.09096063       0.03717550       0.76929942 
          0.65121500       0.44105724       0.92340688 
          0.27355385       0.80121849       0.77750673 
          0.58050742       0.44925776       0.58276787 
          0.46753777       0.50127837       0.29519479 
  
  
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