! Pwscf input file created with ciftopw.py 
! Compound: Ca3V2O8
&control
         calculation     = 'bands'
         prefix          = 'Ca3V2O8'
         restart_mode    = 'from_scratch'
         outdir          = './'
         wf_collect      = .true.
         verbosity       = 'high'
       /
&system
         ibrav           =  14
         celldm(1)       =           10.4812861738061738
         celldm(2)       =            1.0000000000000000
         celldm(3)       =            1.2749217189976914
         celldm(4)       =            0.3951257505911451
         celldm(5)       =            0.3951257505911451
         celldm(6)       =            0.5202891314227450
         nat             =       13
         ntyp            =        3
         ecutwfc         =       48.00000000
         ecutrho         =      646.00000000
         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
 O  15.9994 O.rel-pbe-n-rrkjus_psl.1.0.0.UPF 
Ca  40.0780 Ca.rel-pbe-spn-rrkjus_psl.1.0.0.UPF 
 V  50.9415 V.rel-pbe-spnl-rrkjus_psl.1.0.0.UPF 
ATOMIC_POSITIONS crystal
K_POINTS crystal
295
      0.00000000       0.00000000       0.00000000 1.0 
      0.01351351       0.01351351       0.00000000 1.0 
      0.02702703       0.02702703       0.00000000 1.0 
      0.04054054       0.04054054       0.00000000 1.0 
      0.05405405       0.05405405       0.00000000 1.0 
      0.06756757       0.06756757       0.00000000 1.0 
      0.08108108       0.08108108       0.00000000 1.0 
      0.09459459       0.09459459       0.00000000 1.0 
      0.10810811       0.10810811       0.00000000 1.0 
      0.12162162       0.12162162       0.00000000 1.0 
      0.13513514       0.13513514       0.00000000 1.0 
      0.14864865       0.14864865       0.00000000 1.0 
      0.16216216       0.16216216       0.00000000 1.0 
      0.17567568       0.17567568       0.00000000 1.0 
      0.18918919       0.18918919       0.00000000 1.0 
      0.20270270       0.20270270       0.00000000 1.0 
      0.21621622       0.21621622       0.00000000 1.0 
      0.22972973       0.22972973       0.00000000 1.0 
      0.24324324       0.24324324       0.00000000 1.0 
      0.25675676       0.25675676       0.00000000 1.0 
      0.27027027       0.27027027       0.00000000 1.0 
      0.28378378       0.28378378       0.00000000 1.0 
      0.29729730       0.29729730       0.00000000 1.0 
      0.31081081       0.31081081      -0.00000000 1.0 
      0.32432432       0.32432432       0.00000000 1.0 
      0.33783784       0.33783784       0.00000000 1.0 
      0.35135135       0.35135135       0.00000000 1.0 
      0.36486486       0.36486486       0.00000000 1.0 
      0.37837838       0.37837838       0.00000000 1.0 
      0.39189189       0.39189189       0.00000000 1.0 
      0.40540541       0.40540541       0.00000000 1.0 
      0.41891892       0.41891892       0.00000000 1.0 
      0.43243243       0.43243243       0.00000000 1.0 
      0.44594595       0.44594595       0.00000000 1.0 
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      0.48648649       0.48648649       0.00000000 1.0 
      0.50000000       0.50000000       0.00000000 1.0 
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      0.50657766       0.50657766       0.02122364 1.0 
      0.51315533       0.51315533       0.04244728 1.0 
      0.51973299       0.51973299       0.06367092 1.0 
      0.52631066       0.52631066       0.08489457 1.0 
      0.53288832       0.53288832       0.10611821 1.0 
      0.53946599       0.53946599       0.12734185 1.0 
      0.54604365       0.54604365       0.14856549 1.0 
      0.55262132       0.55262132       0.16978913 1.0 
      0.55919898       0.55919898       0.19101277 1.0 
      0.56577664       0.56577664       0.21223641 1.0 
      0.56577664       0.56577664       0.21223641 1.0 
      0.56212239       0.56212239       0.22822328 1.0 
      0.55846813       0.55846813       0.24421015 1.0 
      0.55481387       0.55481387       0.26019701 1.0 
      0.55115961       0.55115961       0.27618388 1.0 
      0.54750535       0.54750535       0.29217074 1.0 
      0.54385110       0.54385110       0.30815761 1.0 
      0.54019684       0.54019684       0.32414447 1.0 
      0.53654258       0.53654258       0.34013134 1.0 
      0.53288832       0.53288832       0.35611821 1.0 
      0.52923406       0.52923406       0.37210507 1.0 
      0.52557981       0.52557981       0.38809194 1.0 
      0.52192555       0.52192555       0.40407880 1.0 
      0.51827129       0.51827129       0.42006567 1.0 
      0.51461703       0.51461703       0.43605254 1.0 
      0.51096277       0.51096277       0.45203940 1.0 
      0.50730852       0.50730852       0.46802627 1.0 
      0.50365426       0.50365426       0.48401313 1.0 
      0.50000000       0.50000000       0.50000000 1.0 
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      0.50849040       0.49150960       0.50000000 1.0 
      0.51698081       0.48301919       0.50000000 1.0 
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      0.54245202       0.45754798       0.50000000 1.0 
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      0.55943282       0.44056718       0.50000000 1.0 
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      0.57641363       0.42358637       0.50000000 1.0 
      0.58490403       0.41509597       0.50000000 1.0 
      0.59339444       0.40660556       0.50000000 1.0 
      0.60188484       0.39811516       0.50000000 1.0 
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      0.68678887       0.31321113       0.50000000 1.0 
      0.69527928       0.30472072       0.50000000 1.0 
      0.70376968       0.29623032       0.50000000 1.0 
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      0.28773991      -0.28773991       0.50000000 1.0 
      0.27927698      -0.27927698       0.50000000 1.0 
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      0.22003641      -0.22003641       0.50000000 1.0 
      0.21157347      -0.21157347       0.50000000 1.0 
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      0.15233290      -0.15233290       0.50000000 1.0 
      0.14386996      -0.14386996       0.50000000 1.0 
      0.13540702      -0.13540702       0.50000000 1.0 
      0.12694408      -0.12694408       0.50000000 1.0 
      0.11848114      -0.11848114       0.50000000 1.0 
      0.11001820      -0.11001820       0.50000000 1.0 
      0.10155526      -0.10155526       0.50000000 1.0 
      0.09309233      -0.09309233       0.50000000 1.0 
      0.08462939      -0.08462939       0.50000000 1.0 
      0.07616645      -0.07616645       0.50000000 1.0 
      0.06770351      -0.06770351       0.50000000 1.0 
      0.05924057      -0.05924057       0.50000000 1.0 
      0.05077763      -0.05077763       0.50000000 1.0 
      0.04231469      -0.04231469       0.50000000 1.0 
      0.03385175      -0.03385175       0.50000000 1.0 
      0.02538882      -0.02538882       0.50000000 1.0 
      0.01692588      -0.01692588       0.50000000 1.0 
      0.00846294      -0.00846294       0.50000000 1.0 
      0.00000000       0.00000000       0.50000000 1.0 
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      0.01497322       0.01497322       0.50992288 1.0 
      0.02994644       0.02994644       0.51984576 1.0 
      0.04491966       0.04491966       0.52976865 1.0 
      0.05989288       0.05989288       0.53969153 1.0 
      0.07486610       0.07486610       0.54961441 1.0 
      0.08983932       0.08983932       0.55953729 1.0 
      0.10481253       0.10481253       0.56946018 1.0 
      0.11978575       0.11978575       0.57938306 1.0 
      0.13475897       0.13475897       0.58930594 1.0 
      0.14973219       0.14973219       0.59922882 1.0 
      0.16470541       0.16470541       0.60915171 1.0 
      0.17967863       0.17967863       0.61907459 1.0 
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      0.23957151       0.23957151       0.65876612 1.0 
      0.25454473       0.25454473       0.66868900 1.0 
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      0.50000000       0.50000000       0.00000000 1.0 
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      0.00000000       0.00000000       0.00000000 1.0 

