! Pwscf input file created with pymatgen.py 
! Compound: NaBi
&control
         calculation     = 'bands'
         prefix          = 'NaBi'
         restart_mode    = 'from_scratch'
         outdir          = './'
         wf_collect      = .true.
         verbosity       = 'high'
       /
&system
         ibrav           =  14
         celldm(1)       =            6.5384519219400001
         celldm(2)       =            1.0000000000000000
         celldm(3)       =            1.3872832369942196
         celldm(4)       =            0.0000000000000001
         celldm(5)       =            0.0000000000000001
         celldm(6)       =            0.0000000000000001
         nat             =        2
         ntyp            =        2
         ecutwfc         =       67.00000000
         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
Bi 208.9804 Bi_MT_PBE.UPF 
Na  22.9898 Na.rel-pbe-spnl-rrkjus_psl.1.0.0.UPF 
ATOMIC_POSITIONS crystal
K_POINTS crystal
422
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      0.00000000       0.01086957       0.00000000 1.0 
      0.00000000       0.02173913       0.00000000 1.0 
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      0.22307692       0.22307692       0.00000000 1.0 
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      0.16153846       0.16153846       0.00000000 1.0 
      0.15384615       0.15384615       0.00000000 1.0 
      0.14615385       0.14615385       0.00000000 1.0 
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      0.13076923       0.13076923       0.00000000 1.0 
      0.12307692       0.12307692       0.00000000 1.0 
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      0.10000000       0.10000000       0.00000000 1.0 
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      0.00000000       0.50000000       0.15151515 1.0 
     -0.00000000       0.50000000       0.16666667 1.0 
     -0.00000000       0.50000000       0.18181818 1.0 
     -0.00000000       0.50000000       0.19696970 1.0 
      0.00000000       0.50000000       0.21212121 1.0 
      0.00000000       0.50000000       0.22727273 1.0 
     -0.00000000       0.50000000       0.24242424 1.0 
      0.00000000       0.50000000       0.25757576 1.0 
     -0.00000000       0.50000000       0.27272727 1.0 
      0.00000000       0.50000000       0.28787879 1.0 
      0.00000000       0.50000000       0.30303030 1.0 
      0.00000000       0.50000000       0.31818182 1.0 
     -0.00000000       0.50000000       0.33333333 1.0 
     -0.00000000       0.50000000       0.34848485 1.0 
     -0.00000000       0.50000000       0.36363636 1.0 
     -0.00000000       0.50000000       0.37878788 1.0 
     -0.00000000       0.50000000       0.39393939 1.0 
      0.00000000       0.50000000       0.40909091 1.0 
      0.00000000       0.50000000       0.42424242 1.0 
     -0.00000000       0.50000000       0.43939394 1.0 
      0.00000000       0.50000000       0.45454545 1.0 
     -0.00000000       0.50000000       0.46969697 1.0 
     -0.00000000       0.50000000       0.48484848 1.0 
     -0.00000000       0.50000000       0.50000000 1.0 
      0.50000000       0.50000000       0.00000000 1.0 
      0.50000000       0.50000000       0.01515152 1.0 
      0.50000000       0.50000000       0.03030303 1.0 
      0.50000000       0.50000000       0.04545455 1.0 
      0.50000000       0.50000000       0.06060606 1.0 
      0.50000000       0.50000000       0.07575758 1.0 
      0.50000000       0.50000000       0.09090909 1.0 
      0.50000000       0.50000000       0.10606061 1.0 
      0.50000000       0.50000000       0.12121212 1.0 
      0.50000000       0.50000000       0.13636364 1.0 
      0.50000000       0.50000000       0.15151515 1.0 
      0.50000000       0.50000000       0.16666667 1.0 
      0.50000000       0.50000000       0.18181818 1.0 
      0.50000000       0.50000000       0.19696970 1.0 
      0.50000000       0.50000000       0.21212121 1.0 
      0.50000000       0.50000000       0.22727273 1.0 
      0.50000000       0.50000000       0.24242424 1.0 
      0.50000000       0.50000000       0.25757576 1.0 
      0.50000000       0.50000000       0.27272727 1.0 
      0.50000000       0.50000000       0.28787879 1.0 
      0.50000000       0.50000000       0.30303030 1.0 
      0.50000000       0.50000000       0.31818182 1.0 
      0.50000000       0.50000000       0.33333333 1.0 
      0.50000000       0.50000000       0.34848485 1.0 
      0.50000000       0.50000000       0.36363636 1.0 
      0.50000000       0.50000000       0.37878788 1.0 
      0.50000000       0.50000000       0.39393939 1.0 
      0.50000000       0.50000000       0.40909091 1.0 
      0.50000000       0.50000000       0.42424242 1.0 
      0.50000000       0.50000000       0.43939394 1.0 
      0.50000000       0.50000000       0.45454545 1.0 
      0.50000000       0.50000000       0.46969697 1.0 
      0.50000000       0.50000000       0.48484848 1.0 
      0.50000000       0.50000000       0.50000000 1.0 

