! Pwscf input file created with ciftopw.py 
! Compound: Ba(MgGe)2
&control
         calculation     = 'bands'
         prefix          = 'BaxMgGex2'
         restart_mode    = 'from_scratch'
         outdir          = './'
         wf_collect      = .true.
         verbosity       = 'high'
       /
&system
         ibrav           =  14
         celldm(1)       =           12.3912828912806603
         celldm(2)       =            1.0000000000000000
         celldm(3)       =            1.0000000000000000
         celldm(4)       =           -0.7463885288804313
         celldm(5)       =           -0.7463885288804313
         celldm(6)       =            0.4927770577608618
         nat             =        5
         ntyp            =        3
         ecutwfc         =       59.00000000
         ecutrho         =      386.00000000
         occupations     =  'smearing'  
         smearing        =  'f-d' 
         degauss         =        1.00000000e-03  
         noncolin        =  .true. 
         lspinorb        =  .true. 
/
&electrons
         conv_thr        =        1.00000000e-05 
         mixing_beta     =        3.00000000e-01    
   /
ATOMIC_SPECIES
Ge  72.6400 Ge.rel-pbe-n-rrkjus_psl.1.0.0.UPF 
Ba 137.3270 Ba.rel-pbe-spn-rrkjus_psl.1.0.0.UPF 
Mg  24.3050 Mg.rel-pbe-spnl-rrkjus_psl.1.0.0.UPF 
ATOMIC_POSITIONS crystal
K_POINTS crystal
312
      0.00000000       0.00000000       0.00000000 1.0 
      0.00000000       0.00000000       0.01041667 1.0 
      0.00000000       0.00000000       0.02083333 1.0 
      0.00000000       0.00000000       0.03125000 1.0 
      0.00000000       0.00000000       0.04166667 1.0 
      0.00000000       0.00000000       0.05208333 1.0 
      0.00000000       0.00000000       0.06250000 1.0 
      0.00000000       0.00000000       0.07291667 1.0 
      0.00000000       0.00000000       0.08333333 1.0 
     -0.00000000       0.00000000       0.09375000 1.0 
      0.00000000       0.00000000       0.10416667 1.0 
     -0.00000000       0.00000000       0.11458333 1.0 
      0.00000000       0.00000000       0.12500000 1.0 
      0.00000000       0.00000000       0.13541667 1.0 
      0.00000000       0.00000000       0.14583333 1.0 
      0.00000000       0.00000000       0.15625000 1.0 
      0.00000000       0.00000000       0.16666667 1.0 
      0.00000000      -0.00000000       0.17708333 1.0 
     -0.00000000       0.00000000       0.18750000 1.0 
      0.00000000       0.00000000       0.19791667 1.0 
      0.00000000       0.00000000       0.20833333 1.0 
      0.00000000      -0.00000000       0.21875000 1.0 
     -0.00000000       0.00000000       0.22916667 1.0 
     -0.00000000       0.00000000       0.23958333 1.0 
      0.00000000       0.00000000       0.25000000 1.0 
      0.00000000       0.00000000       0.26041667 1.0 
      0.00000000       0.00000000       0.27083333 1.0 
      0.00000000       0.00000000       0.28125000 1.0 
      0.00000000       0.00000000       0.29166667 1.0 
      0.00000000       0.00000000       0.30208333 1.0 
      0.00000000       0.00000000       0.31250000 1.0 
      0.00000000       0.00000000       0.32291667 1.0 
      0.00000000       0.00000000       0.33333333 1.0 
      0.00000000      -0.00000000       0.34375000 1.0 
      0.00000000      -0.00000000       0.35416667 1.0 
      0.00000000       0.00000000       0.36458333 1.0 
     -0.00000000       0.00000000       0.37500000 1.0 
      0.00000000      -0.00000000       0.38541667 1.0 
      0.00000000       0.00000000       0.39583333 1.0 
      0.00000000       0.00000000       0.40625000 1.0 
      0.00000000       0.00000000       0.41666667 1.0 
      0.00000000       0.00000000       0.42708333 1.0 
      0.00000000      -0.00000000       0.43750000 1.0 
      0.00000000       0.00000000       0.44791667 1.0 
     -0.00000000       0.00000000       0.45833333 1.0 
      0.00000000       0.00000000       0.46875000 1.0 
     -0.00000000       0.00000000       0.47916667 1.0 
      0.00000000       0.00000000       0.48958333 1.0 
      0.00000000       0.00000000       0.50000000 1.0 
      0.00000000       0.00000000       0.50000000 1.0 
     -0.00943847       0.00943847       0.50000000 1.0 
     -0.01887693       0.01887693       0.50000000 1.0 
     -0.02831540       0.02831540       0.50000000 1.0 
     -0.03775387       0.03775387       0.50000000 1.0 
     -0.04719233       0.04719233       0.50000000 1.0 
     -0.05663080       0.05663080       0.50000000 1.0 
     -0.06606927       0.06606927       0.50000000 1.0 
     -0.07550773       0.07550773       0.50000000 1.0 
     -0.08494620       0.08494620       0.50000000 1.0 
     -0.08494620       0.08494620       0.50000000 1.0 
     -0.09235787       0.09235787       0.49258832 1.0 
     -0.09976955       0.09976955       0.48517665 1.0 
     -0.10718122       0.10718122       0.47776497 1.0 
     -0.11459290       0.11459290       0.47035330 1.0 
     -0.12200457       0.12200457       0.46294162 1.0 
     -0.12941625       0.12941625       0.45552995 1.0 
     -0.13682792       0.13682792       0.44811827 1.0 
     -0.14423960       0.14423960       0.44070660 1.0 
     -0.15165127       0.15165127       0.43329492 1.0 
     -0.15906295       0.15906295       0.42588325 1.0 
     -0.16647462       0.16647462       0.41847157 1.0 
     -0.17388630       0.17388630       0.41105990 1.0 
     -0.18129797       0.18129797       0.40364822 1.0 
     -0.18870965       0.18870965       0.39623655 1.0 
     -0.19612132       0.19612132       0.38882487 1.0 
     -0.20353300       0.20353300       0.38141320 1.0 
     -0.21094467       0.21094467       0.37400152 1.0 
     -0.21835635       0.21835635       0.36658985 1.0 
     -0.22576802       0.22576802       0.35917817 1.0 
     -0.23317970       0.23317970       0.35176650 1.0 
     -0.24059137       0.24059137       0.34435482 1.0 
     -0.24800305       0.24800305       0.33694315 1.0 
     -0.25541472       0.25541472       0.32953147 1.0 
     -0.26282640       0.26282640       0.32211980 1.0 
     -0.27023807       0.27023807       0.31470812 1.0 
     -0.27764975       0.27764975       0.30729645 1.0 
     -0.28506142       0.28506142       0.29988477 1.0 
     -0.29247310       0.29247310       0.29247310 1.0 
     -0.29247310       0.29247310       0.29247310 1.0 
     -0.28516127       0.28516127       0.28516127 1.0 
     -0.27784944       0.27784944       0.27784944 1.0 
     -0.27053762       0.27053762       0.27053762 1.0 
     -0.26322579       0.26322579       0.26322579 1.0 
     -0.25591396       0.25591396       0.25591396 1.0 
     -0.24860213       0.24860213       0.24860213 1.0 
     -0.24129031       0.24129031       0.24129031 1.0 
     -0.23397848       0.23397848       0.23397848 1.0 
     -0.22666665       0.22666665       0.22666665 1.0 
     -0.21935482       0.21935482       0.21935482 1.0 
     -0.21204300       0.21204300       0.21204300 1.0 
     -0.20473117       0.20473117       0.20473117 1.0 
     -0.19741934       0.19741934       0.19741934 1.0 
     -0.19010751       0.19010751       0.19010751 1.0 
     -0.18279569       0.18279569       0.18279569 1.0 
     -0.17548386       0.17548386       0.17548386 1.0 
     -0.16817203       0.16817203       0.16817203 1.0 
     -0.16086020       0.16086020       0.16086020 1.0 
     -0.15354838       0.15354838       0.15354838 1.0 
     -0.14623655       0.14623655       0.14623655 1.0 
     -0.13892472       0.13892472       0.13892472 1.0 
     -0.13161289       0.13161289       0.13161289 1.0 
     -0.12430107       0.12430107       0.12430107 1.0 
     -0.11698924       0.11698924       0.11698924 1.0 
     -0.10967741       0.10967741       0.10967741 1.0 
     -0.10236558       0.10236558       0.10236558 1.0 
     -0.09505376       0.09505376       0.09505376 1.0 
     -0.08774193       0.08774193       0.08774193 1.0 
     -0.08043010       0.08043010       0.08043010 1.0 
     -0.07311827       0.07311827       0.07311827 1.0 
     -0.06580645       0.06580645       0.06580645 1.0 
     -0.05849462       0.05849462       0.05849462 1.0 
     -0.05118279       0.05118279       0.05118279 1.0 
     -0.04387096       0.04387096       0.04387096 1.0 
     -0.03655914       0.03655914       0.03655914 1.0 
     -0.02924731       0.02924731       0.02924731 1.0 
     -0.02193548       0.02193548       0.02193548 1.0 
     -0.01462365       0.01462365       0.01462365 1.0 
     -0.00731183       0.00731183       0.00731183 1.0 
      0.00000000       0.00000000       0.00000000 1.0 
      0.00000000       0.00000000       0.00000000 1.0 
      0.01785714       0.01785714      -0.01785714 1.0 
      0.03571429       0.03571429      -0.03571429 1.0 
      0.05357143       0.05357143      -0.05357143 1.0 
      0.07142857       0.07142857      -0.07142857 1.0 
      0.08928571       0.08928571      -0.08928571 1.0 
      0.10714286       0.10714286      -0.10714286 1.0 
      0.12500000       0.12500000      -0.12500000 1.0 
      0.14285714       0.14285714      -0.14285714 1.0 
      0.16071429       0.16071429      -0.16071429 1.0 
      0.17857143       0.17857143      -0.17857143 1.0 
      0.19642857       0.19642857      -0.19642857 1.0 
      0.21428571       0.21428571      -0.21428571 1.0 
      0.23214286       0.23214286      -0.23214286 1.0 
      0.25000000       0.25000000      -0.25000000 1.0 
      0.26785714       0.26785714      -0.26785714 1.0 
      0.28571429       0.28571429      -0.28571429 1.0 
      0.30357143       0.30357143      -0.30357143 1.0 
      0.32142857       0.32142857      -0.32142857 1.0 
      0.33928571       0.33928571      -0.33928571 1.0 
      0.35714286       0.35714286      -0.35714286 1.0 
      0.37500000       0.37500000      -0.37500000 1.0 
      0.39285714       0.39285714      -0.39285714 1.0 
      0.41071429       0.41071429      -0.41071429 1.0 
      0.42857143       0.42857143      -0.42857143 1.0 
      0.44642857       0.44642857      -0.44642857 1.0 
      0.46428571       0.46428571      -0.46428571 1.0 
      0.48214286       0.48214286      -0.48214286 1.0 
      0.50000000       0.50000000      -0.50000000 1.0 
      0.50000000       0.50000000      -0.50000000 1.0 
      0.49258832       0.50741168      -0.49258832 1.0 
      0.48517665       0.51482335      -0.48517665 1.0 
      0.47776497       0.52223503      -0.47776497 1.0 
      0.47035330       0.52964670      -0.47035330 1.0 
      0.46294162       0.53705838      -0.46294162 1.0 
      0.45552995       0.54447005      -0.45552995 1.0 
      0.44811827       0.55188173      -0.44811827 1.0 
      0.44070660       0.55929340      -0.44070660 1.0 
      0.43329492       0.56670508      -0.43329492 1.0 
      0.42588325       0.57411675      -0.42588325 1.0 
      0.41847157       0.58152843      -0.41847157 1.0 
      0.41105990       0.58894010      -0.41105990 1.0 
      0.40364822       0.59635178      -0.40364822 1.0 
      0.39623655       0.60376345      -0.39623655 1.0 
      0.38882487       0.61117513      -0.38882487 1.0 
      0.38141320       0.61858680      -0.38141320 1.0 
      0.37400152       0.62599848      -0.37400152 1.0 
      0.36658985       0.63341015      -0.36658985 1.0 
      0.35917817       0.64082183      -0.35917817 1.0 
      0.35176650       0.64823350      -0.35176650 1.0 
      0.34435482       0.65564518      -0.34435482 1.0 
      0.33694315       0.66305685      -0.33694315 1.0 
      0.32953147       0.67046853      -0.32953147 1.0 
      0.32211980       0.67788020      -0.32211980 1.0 
      0.31470812       0.68529188      -0.31470812 1.0 
      0.30729645       0.69270355      -0.30729645 1.0 
      0.29988477       0.70011523      -0.29988477 1.0 
      0.29247310       0.70752690      -0.29247310 1.0 
      0.29247310       0.70752690      -0.29247310 1.0 
      0.27297489       0.69369177      -0.27297489 1.0 
      0.25347669       0.67985665      -0.25347669 1.0 
      0.23397848       0.66602152      -0.23397848 1.0 
      0.21448027       0.65218639      -0.21448027 1.0 
      0.19498207       0.63835127      -0.19498207 1.0 
      0.17548386       0.62451614      -0.17548386 1.0 
      0.15598565       0.61068101      -0.15598565 1.0 
      0.13648745       0.59684589      -0.13648745 1.0 
      0.11698924       0.58301076      -0.11698924 1.0 
      0.09749103       0.56917563      -0.09749103 1.0 
      0.07799283       0.55534051      -0.07799283 1.0 
      0.05849462       0.54150538      -0.05849462 1.0 
      0.03899641       0.52767025      -0.03899641 1.0 
      0.01949821       0.51383513      -0.01949821 1.0 
      0.00000000       0.50000000      -0.00000000 1.0 
      0.00000000       0.50000000      -0.00000000 1.0 
      0.00735294       0.49264706       0.00735294 1.0 
      0.01470588       0.48529412       0.01470588 1.0 
      0.02205882       0.47794118       0.02205882 1.0 
      0.02941176       0.47058824       0.02941176 1.0 
      0.03676471       0.46323529       0.03676471 1.0 
      0.04411765       0.45588235       0.04411765 1.0 
      0.05147059       0.44852941       0.05147059 1.0 
      0.05882353       0.44117647       0.05882353 1.0 
      0.06617647       0.43382353       0.06617647 1.0 
      0.07352941       0.42647059       0.07352941 1.0 
      0.08088235       0.41911765       0.08088235 1.0 
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      0.13235294       0.36764706       0.13235294 1.0 
      0.13970588       0.36029412       0.13970588 1.0 
      0.14705882       0.35294118       0.14705882 1.0 
      0.15441176       0.34558824       0.15441176 1.0 
      0.16176471       0.33823529       0.16176471 1.0 
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      0.17647059       0.32352941       0.17647059 1.0 
      0.18382353       0.31617647       0.18382353 1.0 
      0.19117647       0.30882353       0.19117647 1.0 
      0.19852941       0.30147059       0.19852941 1.0 
      0.20588235       0.29411765       0.20588235 1.0 
      0.21323529       0.28676471       0.21323529 1.0 
      0.22058824       0.27941176       0.22058824 1.0 
      0.22794118       0.27205882       0.22794118 1.0 
      0.23529412       0.26470588       0.23529412 1.0 
      0.24264706       0.25735294       0.24264706 1.0 
      0.25000000       0.25000000       0.25000000 1.0 
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      0.08928571       0.08928571       0.41071429 1.0 
      0.10714286       0.10714286       0.39285714 1.0 
      0.12500000       0.12500000       0.37500000 1.0 
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      0.17857143       0.17857143       0.32142857 1.0 
      0.19642857       0.19642857       0.30357143 1.0 
      0.21428571       0.21428571       0.28571429 1.0 
      0.23214286       0.23214286       0.26785714 1.0 
      0.25000000       0.25000000       0.25000000 1.0 

