! Pwscf input file created with pymatgen.py 
! Compound: RbBrO3
&control
         calculation     = 'bands'
         prefix          = 'RbBrO3'
         restart_mode    = 'from_scratch'
         outdir          = './'
         wf_collect      = .true.
         verbosity       = 'high'
       /
&system
         ibrav           =  14
         celldm(1)       =            8.4873263343956999
         celldm(2)       =            1.0000000000000000
         celldm(3)       =            1.0000000000000000
         celldm(4)       =            0.0415617679735749
         celldm(5)       =            0.0415617679735749
         celldm(6)       =            0.0415617679735749
         nat             =        5
         ntyp            =        3
         ecutwfc         =       50.00000000
         ecutrho         =      324.00000000
         occupations     =  'smearing'  
         smearing        =  'f-d' 
         degauss         =        1.00000000e-03  
         noncolin        =  .true. 
         lspinorb        =  .true. 
/
&electrons
         conv_thr        =        1.00000000e-08 
         mixing_beta     =        3.00000000e-01    
   /
ATOMIC_SPECIES
 O  15.9994 O.rel-pbe-n-rrkjus_psl.1.0.0.UPF 
Br  79.9040 Br.rel-pbe-n-rrkjus_psl.1.0.0.UPF 
Rb  85.4678 Rb.rel-pbe-spn-rrkjus_psl.1.0.0.UPF 
ATOMIC_POSITIONS crystal
K_POINTS crystal
290
      0.00000000       0.00000000       0.00000000 1.0 
      0.01388889       0.00000000       0.00000000 1.0 
      0.02777778       0.00000000       0.00000000 1.0 
      0.04166667       0.00000000      -0.00000000 1.0 
      0.05555556       0.00000000       0.00000000 1.0 
      0.06944444       0.00000000       0.00000000 1.0 
      0.08333333       0.00000000      -0.00000000 1.0 
      0.09722222       0.00000000       0.00000000 1.0 
      0.11111111       0.00000000       0.00000000 1.0 
      0.12500000       0.00000000       0.00000000 1.0 
      0.13888889       0.00000000       0.00000000 1.0 
      0.15277778       0.00000000       0.00000000 1.0 
      0.16666667       0.00000000      -0.00000000 1.0 
      0.18055556       0.00000000       0.00000000 1.0 
      0.19444444       0.00000000       0.00000000 1.0 
      0.20833333       0.00000000       0.00000000 1.0 
      0.22222222       0.00000000       0.00000000 1.0 
      0.23611111       0.00000000       0.00000000 1.0 
      0.25000000       0.00000000       0.00000000 1.0 
      0.26388889       0.00000000      -0.00000000 1.0 
      0.27777778       0.00000000       0.00000000 1.0 
      0.29166667       0.00000000       0.00000000 1.0 
      0.30555556       0.00000000       0.00000000 1.0 
      0.31944444       0.00000000      -0.00000000 1.0 
      0.33333333       0.00000000      -0.00000000 1.0 
      0.34722222       0.00000000      -0.00000000 1.0 
      0.36111111       0.00000000       0.00000000 1.0 
      0.37500000       0.00000000       0.00000000 1.0 
      0.38888889       0.00000000       0.00000000 1.0 
      0.40277778       0.00000000       0.00000000 1.0 
      0.41666667       0.00000000       0.00000000 1.0 
      0.43055556       0.00000000       0.00000000 1.0 
      0.44444444       0.00000000       0.00000000 1.0 
      0.45833333       0.00000000       0.00000000 1.0 
      0.47222222       0.00000000       0.00000000 1.0 
      0.48611111       0.00000000       0.00000000 1.0 
      0.50000000       0.00000000       0.00000000 1.0 
      0.50000000       0.00000000       0.00000000 1.0 
      0.50000000       0.00982187      -0.00982187 1.0 
      0.50000000       0.01964374      -0.01964374 1.0 
      0.50000000       0.02946561      -0.02946561 1.0 
      0.50000000       0.03928748      -0.03928748 1.0 
      0.50000000       0.04910935      -0.04910935 1.0 
      0.50000000       0.05893122      -0.05893122 1.0 
      0.50000000       0.06875309      -0.06875309 1.0 
      0.50000000       0.07857495      -0.07857495 1.0 
      0.50000000       0.08839682      -0.08839682 1.0 
      0.50000000       0.09821869      -0.09821869 1.0 
      0.50000000       0.10804056      -0.10804056 1.0 
      0.50000000       0.11786243      -0.11786243 1.0 
      0.50000000       0.12768430      -0.12768430 1.0 
      0.50000000       0.13750617      -0.13750617 1.0 
      0.50000000       0.14732804      -0.14732804 1.0 
      0.50000000       0.15714991      -0.15714991 1.0 
      0.50000000       0.16697178      -0.16697178 1.0 
      0.50000000       0.17679365      -0.17679365 1.0 
      0.50000000       0.18661552      -0.18661552 1.0 
      0.50000000       0.19643739      -0.19643739 1.0 
      0.50000000       0.20625926      -0.20625926 1.0 
      0.50000000       0.21608113      -0.21608113 1.0 
      0.50000000       0.22590300      -0.22590300 1.0 
      0.50000000       0.23572486      -0.23572486 1.0 
      0.50000000       0.24554673      -0.24554673 1.0 
      0.50000000       0.25536860      -0.25536860 1.0 
      0.50000000       0.26519047      -0.26519047 1.0 
      0.50000000       0.27501234      -0.27501234 1.0 
      0.50000000       0.28483421      -0.28483421 1.0 
      0.50000000       0.29465608      -0.29465608 1.0 
      0.50000000       0.30447795      -0.30447795 1.0 
      0.50000000       0.31429982      -0.31429982 1.0 
      0.50000000       0.32412169      -0.32412169 1.0 
      0.50000000       0.33394356      -0.33394356 1.0 
      0.50000000       0.34376543      -0.34376543 1.0 
      0.50000000       0.35358730      -0.35358730 1.0 
      0.50000000       0.36340917      -0.36340917 1.0 
      0.50000000       0.37323104      -0.37323104 1.0 
      0.50000000       0.38305291      -0.38305291 1.0 
      0.50000000       0.39287477      -0.39287477 1.0 
      0.50000000       0.40269664      -0.40269664 1.0 
      0.50000000       0.41251851      -0.41251851 1.0 
      0.50000000       0.42234038      -0.42234038 1.0 
      0.50000000       0.43216225      -0.43216225 1.0 
      0.50000000       0.44198412      -0.44198412 1.0 
      0.50000000       0.45180599      -0.45180599 1.0 
      0.50000000       0.46162786      -0.46162786 1.0 
      0.53837214       0.50000000       0.46162786 1.0 
      0.52877911       0.50000000       0.47122089 1.0 
      0.51918607       0.50000000       0.48081393 1.0 
      0.50959304       0.50000000       0.49040696 1.0 
      0.50000000       0.50000000       0.50000000 1.0 
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      0.49152542       0.49152542       0.49152542 1.0 
      0.48305085       0.48305085       0.48305085 1.0 
      0.47457627       0.47457627       0.47457627 1.0 
      0.46610169       0.46610169       0.46610169 1.0 
      0.45762712       0.45762712       0.45762712 1.0 
      0.44915254       0.44915254       0.44915254 1.0 
      0.44067797       0.44067797       0.44067797 1.0 
      0.43220339       0.43220339       0.43220339 1.0 
      0.42372881       0.42372881       0.42372881 1.0 
      0.41525424       0.41525424       0.41525424 1.0 
      0.40677966       0.40677966       0.40677966 1.0 
      0.39830508       0.39830508       0.39830508 1.0 
      0.38983051       0.38983051       0.38983051 1.0 
      0.38135593       0.38135593       0.38135593 1.0 
      0.37288136       0.37288136       0.37288136 1.0 
      0.36440678       0.36440678       0.36440678 1.0 
      0.35593220       0.35593220       0.35593220 1.0 
      0.34745763       0.34745763       0.34745763 1.0 
      0.33898305       0.33898305       0.33898305 1.0 
      0.33050847       0.33050847       0.33050847 1.0 
      0.32203390       0.32203390       0.32203390 1.0 
      0.31355932       0.31355932       0.31355932 1.0 
      0.30508475       0.30508475       0.30508475 1.0 
      0.29661017       0.29661017       0.29661017 1.0 
      0.28813559       0.28813559       0.28813559 1.0 
      0.27966102       0.27966102       0.27966102 1.0 
      0.27118644       0.27118644       0.27118644 1.0 
      0.26271186       0.26271186       0.26271186 1.0 
      0.25423729       0.25423729       0.25423729 1.0 
      0.24576271       0.24576271       0.24576271 1.0 
      0.23728814       0.23728814       0.23728814 1.0 
      0.22881356       0.22881356       0.22881356 1.0 
      0.22033898       0.22033898       0.22033898 1.0 
      0.21186441       0.21186441       0.21186441 1.0 
      0.20338983       0.20338983       0.20338983 1.0 
      0.19491525       0.19491525       0.19491525 1.0 
      0.18644068       0.18644068       0.18644068 1.0 
      0.17796610       0.17796610       0.17796610 1.0 
      0.16949153       0.16949153       0.16949153 1.0 
      0.16101695       0.16101695       0.16101695 1.0 
      0.15254237       0.15254237       0.15254237 1.0 
      0.14406780       0.14406780       0.14406780 1.0 
      0.13559322       0.13559322       0.13559322 1.0 
      0.12711864       0.12711864       0.12711864 1.0 
      0.11864407       0.11864407       0.11864407 1.0 
      0.11016949       0.11016949       0.11016949 1.0 
      0.10169492       0.10169492       0.10169492 1.0 
      0.09322034       0.09322034       0.09322034 1.0 
      0.08474576       0.08474576       0.08474576 1.0 
      0.07627119       0.07627119       0.07627119 1.0 
      0.06779661       0.06779661       0.06779661 1.0 
      0.05932203       0.05932203       0.05932203 1.0 
      0.05084746       0.05084746       0.05084746 1.0 
      0.04237288       0.04237288       0.04237288 1.0 
      0.03389831       0.03389831       0.03389831 1.0 
      0.02542373       0.02542373       0.02542373 1.0 
      0.01694915       0.01694915       0.01694915 1.0 
      0.00847458       0.00847458       0.00847458 1.0 
      0.00000000       0.00000000       0.00000000 1.0 
      0.00000000       0.00000000       0.00000000 1.0 
      0.00981253       0.00000000      -0.00981253 1.0 
      0.01962506       0.00000000      -0.01962506 1.0 
      0.02943759       0.00000000      -0.02943759 1.0 
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      0.04906265       0.00000000      -0.04906265 1.0 
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      0.06868770       0.00000000      -0.06868770 1.0 
      0.07850023       0.00000000      -0.07850023 1.0 
      0.08831276       0.00000000      -0.08831276 1.0 
      0.09812529       0.00000000      -0.09812529 1.0 
      0.10793782       0.00000000      -0.10793782 1.0 
      0.11775035       0.00000000      -0.11775035 1.0 
      0.12756288       0.00000000      -0.12756288 1.0 
      0.13737541       0.00000000      -0.13737541 1.0 
      0.14718794       0.00000000      -0.14718794 1.0 
      0.15700047       0.00000000      -0.15700047 1.0 
      0.16681300       0.00000000      -0.16681300 1.0 
      0.17662553       0.00000000      -0.17662553 1.0 
      0.18643805       0.00000000      -0.18643805 1.0 
      0.19625058       0.00000000      -0.19625058 1.0 
      0.20606311       0.00000000      -0.20606311 1.0 
      0.21587564       0.00000000      -0.21587564 1.0 
      0.22568817       0.00000000      -0.22568817 1.0 
      0.23550070       0.00000000      -0.23550070 1.0 
      0.24531323       0.00000000      -0.24531323 1.0 
      0.25512576       0.00000000      -0.25512576 1.0 
      0.26493829       0.00000000      -0.26493829 1.0 
      0.27475082       0.00000000      -0.27475082 1.0 
      0.28456335       0.00000000      -0.28456335 1.0 
      0.29437588       0.00000000      -0.29437588 1.0 
      0.30418840       0.00000000      -0.30418840 1.0 
      0.31400093       0.00000000      -0.31400093 1.0 
      0.32381346       0.00000000      -0.32381346 1.0 
      0.33362599       0.00000000      -0.33362599 1.0 
      0.34343852       0.00000000      -0.34343852 1.0 
      0.35325105       0.00000000      -0.35325105 1.0 
      0.36306358       0.00000000      -0.36306358 1.0 
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      0.38268864       0.00000000      -0.38268864 1.0 
      0.39250117       0.00000000      -0.39250117 1.0 
      0.40231370       0.00000000      -0.40231370 1.0 
      0.41212623       0.00000000      -0.41212623 1.0 
      0.42193875       0.00000000      -0.42193875 1.0 
      0.43175128       0.00000000      -0.43175128 1.0 
      0.44156381       0.00000000      -0.44156381 1.0 
      0.45137634       0.00000000      -0.45137634 1.0 
      0.46118887       0.00000000      -0.46118887 1.0 
      0.47100140       0.00000000      -0.47100140 1.0 
      0.48081393       0.00000000      -0.48081393 1.0 
      0.51918607       0.48081393       0.00000000 1.0 
      0.50959304       0.49040696       0.00000000 1.0 
      0.50000000       0.50000000       0.00000000 1.0 
      0.50000000       0.50000000       0.00000000 1.0 
      0.50058140       0.50058140       0.01398872 1.0 
      0.50116279       0.50116279       0.02797745 1.0 
      0.50174419       0.50174419       0.04196617 1.0 
      0.50232558       0.50232558       0.05595489 1.0 
      0.50290698       0.50290698       0.06994362 1.0 
      0.50348838       0.50348838       0.08393234 1.0 
      0.50406977       0.50406977       0.09792106 1.0 
      0.50465117       0.50465117       0.11190978 1.0 
      0.50523256       0.50523256       0.12589851 1.0 
      0.50581396       0.50581396       0.13988723 1.0 
      0.50639536       0.50639536       0.15387595 1.0 
      0.50697675       0.50697675       0.16786468 1.0 
      0.50755815       0.50755815       0.18185340 1.0 
      0.50813954       0.50813954       0.19584212 1.0 
      0.50872094       0.50872094       0.20983085 1.0 
      0.50930234       0.50930234       0.22381957 1.0 
      0.50988373       0.50988373       0.23780829 1.0 
      0.51046513       0.51046513       0.25179701 1.0 
      0.51104653       0.51104653       0.26578574 1.0 
      0.51162792       0.51162792       0.27977446 1.0 
      0.51220932       0.51220932       0.29376318 1.0 
      0.51279071       0.51279071       0.30775191 1.0 
      0.51337211       0.51337211       0.32174063 1.0 
      0.51395351       0.51395351       0.33572935 1.0 
      0.51453490       0.51453490       0.34971808 1.0 
      0.51511630       0.51511630       0.36370680 1.0 
      0.51569769       0.51569769       0.37769552 1.0 
      0.51627909       0.51627909       0.39168424 1.0 
      0.51686049       0.51686049       0.40567297 1.0 
      0.51744188       0.51744188       0.41966169 1.0 
      0.51802328       0.51802328       0.43365041 1.0 
      0.51860467       0.51860467       0.44763914 1.0 
      0.51918607       0.51918607       0.46162786 1.0 
      0.51918607       0.51918607       0.46162786 1.0 
      0.51438955       0.51438955       0.47122089 1.0 
      0.50959304       0.50959304       0.48081393 1.0 
      0.50479652       0.50479652       0.49040696 1.0 
      0.50000000       0.50000000       0.50000000 1.0 
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      0.50081643       0.01023008       0.01023008 1.0 
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      0.50244929       0.03069025       0.03069025 1.0 
      0.50326571       0.04092033       0.04092033 1.0 
      0.50408214       0.05115042       0.05115042 1.0 
      0.50489857       0.06138050       0.06138050 1.0 
      0.50571500       0.07161059       0.07161059 1.0 
      0.50653143       0.08184067       0.08184067 1.0 
      0.50734786       0.09207075       0.09207075 1.0 
      0.50816429       0.10230084       0.10230084 1.0 
      0.50898071       0.11253092       0.11253092 1.0 
      0.50979714       0.12276100       0.12276100 1.0 
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      0.51143000       0.14322117       0.14322117 1.0 
      0.51224643       0.15345125       0.15345125 1.0 
      0.51306286       0.16368134       0.16368134 1.0 
      0.51387928       0.17391142       0.17391142 1.0 
      0.51469571       0.18414151       0.18414151 1.0 
      0.51551214       0.19437159       0.19437159 1.0 
      0.51632857       0.20460167       0.20460167 1.0 
      0.51714500       0.21483176       0.21483176 1.0 
      0.51796143       0.22506184       0.22506184 1.0 
      0.51877786       0.23529192       0.23529192 1.0 
      0.51959428       0.24552201       0.24552201 1.0 
      0.52041071       0.25575209       0.25575209 1.0 
      0.52122714       0.26598217       0.26598217 1.0 
      0.52204357       0.27621226       0.27621226 1.0 
      0.52286000       0.28644234       0.28644234 1.0 
      0.52367643       0.29667242       0.29667242 1.0 
      0.52449286       0.30690251       0.30690251 1.0 
      0.52530928       0.31713259       0.31713259 1.0 
      0.52612571       0.32736268       0.32736268 1.0 
      0.52694214       0.33759276       0.33759276 1.0 
      0.52775857       0.34782284       0.34782284 1.0 
      0.52857500       0.35805293       0.35805293 1.0 
      0.52939143       0.36828301       0.36828301 1.0 
      0.53020785       0.37851309       0.37851309 1.0 
      0.53102428       0.38874318       0.38874318 1.0 
      0.53184071       0.39897326       0.39897326 1.0 
      0.53265714       0.40920334       0.40920334 1.0 
      0.53347357       0.41943343       0.41943343 1.0 
      0.53429000       0.42966351       0.42966351 1.0 
      0.53510643       0.43989360       0.43989360 1.0 
      0.53592285       0.45012368       0.45012368 1.0 
      0.53673928       0.46035376       0.46035376 1.0 
      0.53755571       0.47058385       0.47058385 1.0 
      0.53837214       0.48081393       0.48081393 1.0 

