! Pwscf input file created with ciftopw.py 
! Compound: NaVO3
&control
         calculation     = 'bands'
         prefix          = 'NaVO3'
         restart_mode    = 'from_scratch'
         outdir          = './'
         wf_collect      = .true.
         verbosity       = 'high'
       /
&system
         ibrav           =  14
         celldm(1)       =           13.4189392248521440
         celldm(2)       =            1.0000000000000000
         celldm(3)       =            0.8291792992567636
         celldm(4)       =            0.2368407262737223
         celldm(5)       =            0.2368407262737223
         celldm(6)       =            0.1084797624281847
         nat             =       20
         ntyp            =        3
         ecutwfc         =       67.00000000
         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 
Na  22.9898 Na.rel-pbe-spnl-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
222
      0.00000000       0.00000000       0.00000000 1.0 
      0.01562500       0.01562500       0.00000000 1.0 
      0.03125000       0.03125000       0.00000000 1.0 
      0.04687500       0.04687500       0.00000000 1.0 
      0.06250000       0.06250000       0.00000000 1.0 
      0.07812500       0.07812500       0.00000000 1.0 
      0.09375000       0.09375000       0.00000000 1.0 
      0.10937500       0.10937500      -0.00000000 1.0 
      0.12500000       0.12500000       0.00000000 1.0 
      0.14062500       0.14062500       0.00000000 1.0 
      0.15625000       0.15625000       0.00000000 1.0 
      0.17187500       0.17187500       0.00000000 1.0 
      0.18750000       0.18750000       0.00000000 1.0 
      0.20312500       0.20312500       0.00000000 1.0 
      0.21875000       0.21875000      -0.00000000 1.0 
      0.23437500       0.23437500       0.00000000 1.0 
      0.25000000       0.25000000       0.00000000 1.0 
      0.26562500       0.26562500       0.00000000 1.0 
      0.28125000       0.28125000       0.00000000 1.0 
      0.29687500       0.29687500       0.00000000 1.0 
      0.31250000       0.31250000       0.00000000 1.0 
      0.32812500       0.32812500       0.00000000 1.0 
      0.34375000       0.34375000       0.00000000 1.0 
      0.35937500       0.35937500       0.00000000 1.0 
      0.37500000       0.37500000       0.00000000 1.0 
      0.39062500       0.39062500       0.00000000 1.0 
      0.40625000       0.40625000       0.00000000 1.0 
      0.42187500       0.42187500       0.00000000 1.0 
      0.43750000       0.43750000      -0.00000000 1.0 
      0.45312500       0.45312500       0.00000000 1.0 
      0.46875000       0.46875000       0.00000000 1.0 
      0.48437500       0.48437500       0.00000000 1.0 
      0.50000000       0.50000000       0.00000000 1.0 
      0.50000000       0.50000000       0.00000000 1.0 
      0.50512979       0.50512979       0.01795940 1.0 
      0.51025959       0.51025959       0.03591881 1.0 
      0.51538938       0.51538938       0.05387821 1.0 
      0.52051917       0.52051917       0.07183761 1.0 
      0.52564897       0.52564897       0.08979702 1.0 
      0.53077876       0.53077876       0.10775642 1.0 
      0.53590855       0.53590855       0.12571582 1.0 
      0.54103834       0.54103834       0.14367523 1.0 
      0.54616814       0.54616814       0.16163463 1.0 
      0.55129793       0.55129793       0.17959404 1.0 
      0.55642772       0.55642772       0.19755344 1.0 
      0.56155752       0.56155752       0.21551284 1.0 
      0.56668731       0.56668731       0.23347225 1.0 
      0.57181710       0.57181710       0.25143165 1.0 
      0.57694690       0.57694690       0.26939105 1.0 
      0.58207669       0.58207669       0.28735046 1.0 
      0.58720648       0.58720648       0.30530986 1.0 
      0.59233627       0.59233627       0.32326926 1.0 
      0.59746607       0.59746607       0.34122867 1.0 
      0.60259586       0.60259586       0.35918807 1.0 
      0.60259586       0.60259586       0.35918807 1.0 
      0.59404621       0.59404621       0.37092240 1.0 
      0.58549655       0.58549655       0.38265673 1.0 
      0.57694690       0.57694690       0.39439105 1.0 
      0.56839724       0.56839724       0.40612538 1.0 
      0.55984759       0.55984759       0.41785971 1.0 
      0.55129793       0.55129793       0.42959404 1.0 
      0.54274828       0.54274828       0.44132836 1.0 
      0.53419862       0.53419862       0.45306269 1.0 
      0.52564897       0.52564897       0.46479702 1.0 
      0.51709931       0.51709931       0.47653135 1.0 
      0.50854966       0.50854966       0.48826567 1.0 
      0.50000000       0.50000000       0.50000000 1.0 
      0.50000000       0.50000000       0.50000000 1.0 
      0.51400800       0.48599200       0.50000000 1.0 
      0.52801601       0.47198399       0.50000000 1.0 
      0.54202401       0.45797599       0.50000000 1.0 
      0.55603201       0.44396799       0.50000000 1.0 
      0.57004002       0.42995998       0.50000000 1.0 
      0.58404802       0.41595198       0.50000000 1.0 
      0.59805602       0.40194398       0.50000000 1.0 
      0.61206403       0.38793597       0.50000000 1.0 
      0.62607203       0.37392797       0.50000000 1.0 
      0.64008003       0.35991997       0.50000000 1.0 
      0.65408804       0.34591196       0.50000000 1.0 
      0.34591196      -0.34591196       0.50000000 1.0 
      0.33087231      -0.33087231       0.50000000 1.0 
      0.31583266      -0.31583266       0.50000000 1.0 
      0.30079301      -0.30079301       0.50000000 1.0 
      0.28575336      -0.28575336       0.50000000 1.0 
      0.27071371      -0.27071371       0.50000000 1.0 
      0.25567406      -0.25567406       0.50000000 1.0 
      0.24063441      -0.24063441       0.50000000 1.0 
      0.22559476      -0.22559476       0.50000000 1.0 
      0.21055511      -0.21055511       0.50000000 1.0 
      0.19551546      -0.19551546       0.50000000 1.0 
      0.18047581      -0.18047581       0.50000000 1.0 
      0.16543616      -0.16543616       0.50000000 1.0 
      0.15039651      -0.15039651       0.50000000 1.0 
      0.13535686      -0.13535686       0.50000000 1.0 
      0.12031721      -0.12031721       0.50000000 1.0 
      0.10527755      -0.10527755       0.50000000 1.0 
      0.09023790      -0.09023790       0.50000000 1.0 
      0.07519825      -0.07519825       0.50000000 1.0 
      0.06015860      -0.06015860       0.50000000 1.0 
      0.04511895      -0.04511895       0.50000000 1.0 
      0.03007930      -0.03007930       0.50000000 1.0 
      0.01503965      -0.01503965       0.50000000 1.0 
      0.00000000       0.00000000       0.50000000 1.0 
      0.00000000       0.00000000       0.50000000 1.0 
      0.01655851       0.01655851       0.50586716 1.0 
      0.03311701       0.03311701       0.51173433 1.0 
      0.04967552       0.04967552       0.51760149 1.0 
      0.06623402       0.06623402       0.52346865 1.0 
      0.08279253       0.08279253       0.52933582 1.0 
      0.09935103       0.09935103       0.53520298 1.0 
      0.11590954       0.11590954       0.54107015 1.0 
      0.13246805       0.13246805       0.54693731 1.0 
      0.14902655       0.14902655       0.55280447 1.0 
      0.16558506       0.16558506       0.55867164 1.0 
      0.18214356       0.18214356       0.56453880 1.0 
      0.19870207       0.19870207       0.57040596 1.0 
      0.21526058       0.21526058       0.57627313 1.0 
      0.23181908       0.23181908       0.58214029 1.0 
      0.24837759       0.24837759       0.58800746 1.0 
      0.26493609       0.26493609       0.59387462 1.0 
      0.28149460       0.28149460       0.59974178 1.0 
      0.29805310       0.29805310       0.60560895 1.0 
      0.31461161       0.31461161       0.61147611 1.0 
      0.33117012       0.33117012       0.61734327 1.0 
      0.34772862       0.34772862       0.62321044 1.0 
      0.36428713       0.36428713       0.62907760 1.0 
      0.38084563       0.38084563       0.63494477 1.0 
      0.39740414       0.39740414       0.64081193 1.0 
      0.50000000       0.50000000       0.00000000 1.0 
      0.51314529       0.48685471       0.00000000 1.0 
      0.52629058       0.47370942       0.00000000 1.0 
      0.47370942      -0.47370942       0.00000000 1.0 
      0.45890600      -0.45890600       0.00000000 1.0 
      0.44410258      -0.44410258       0.00000000 1.0 
      0.42929916      -0.42929916       0.00000000 1.0 
      0.41449574      -0.41449574       0.00000000 1.0 
      0.39969232      -0.39969232       0.00000000 1.0 
      0.38488890      -0.38488890       0.00000000 1.0 
      0.37008548      -0.37008548       0.00000000 1.0 
      0.35528206      -0.35528206       0.00000000 1.0 
      0.34047864      -0.34047864       0.00000000 1.0 
      0.32567522      -0.32567522       0.00000000 1.0 
      0.31087180      -0.31087180       0.00000000 1.0 
      0.29606839      -0.29606839       0.00000000 1.0 
      0.28126497      -0.28126497       0.00000000 1.0 
      0.26646155      -0.26646155       0.00000000 1.0 
      0.25165813      -0.25165813       0.00000000 1.0 
      0.23685471      -0.23685471       0.00000000 1.0 
      0.22205129      -0.22205129       0.00000000 1.0 
      0.20724787      -0.20724787       0.00000000 1.0 
      0.19244445      -0.19244445       0.00000000 1.0 
      0.17764103      -0.17764103       0.00000000 1.0 
      0.16283761      -0.16283761       0.00000000 1.0 
      0.14803419      -0.14803419       0.00000000 1.0 
      0.13323077      -0.13323077       0.00000000 1.0 
      0.11842735      -0.11842735       0.00000000 1.0 
      0.10362393      -0.10362393       0.00000000 1.0 
      0.08882052      -0.08882052       0.00000000 1.0 
      0.07401710      -0.07401710       0.00000000 1.0 
      0.05921368      -0.05921368       0.00000000 1.0 
      0.04441026      -0.04441026       0.00000000 1.0 
      0.02960684      -0.02960684       0.00000000 1.0 
      0.01480342      -0.01480342       0.00000000 1.0 
      0.00000000       0.00000000       0.00000000 1.0 
      0.00000000       0.00000000       0.00000000 1.0 
      0.02173913      -0.00000000       0.00000000 1.0 
      0.04347826      -0.00000000       0.00000000 1.0 
      0.06521739      -0.00000000       0.00000000 1.0 
      0.08695652      -0.00000000       0.00000000 1.0 
      0.10869565      -0.00000000       0.00000000 1.0 
      0.13043478      -0.00000000       0.00000000 1.0 
      0.15217391       0.00000000       0.00000000 1.0 
      0.17391304      -0.00000000       0.00000000 1.0 
      0.19565217      -0.00000000       0.00000000 1.0 
      0.21739130      -0.00000000       0.00000000 1.0 
      0.23913043       0.00000000       0.00000000 1.0 
      0.26086957      -0.00000000       0.00000000 1.0 
      0.28260870       0.00000000       0.00000000 1.0 
      0.30434783       0.00000000       0.00000000 1.0 
      0.32608696      -0.00000000       0.00000000 1.0 
      0.34782609      -0.00000000       0.00000000 1.0 
      0.36956522      -0.00000000      -0.00000000 1.0 
      0.39130435      -0.00000000       0.00000000 1.0 
      0.41304348      -0.00000000       0.00000000 1.0 
      0.43478261      -0.00000000       0.00000000 1.0 
      0.45652174       0.00000000       0.00000000 1.0 
      0.47826087       0.00000000       0.00000000 1.0 
      0.50000000       0.00000000       0.00000000 1.0 
      0.50000000       0.00000000       0.50000000 1.0 
      0.48484848      -0.00000000       0.48484848 1.0 
      0.46969697      -0.00000000       0.46969697 1.0 
      0.45454545       0.00000000       0.45454545 1.0 
      0.43939394      -0.00000000       0.43939394 1.0 
      0.42424242       0.00000000       0.42424242 1.0 
      0.40909091      -0.00000000       0.40909091 1.0 
      0.39393939      -0.00000000       0.39393939 1.0 
      0.37878788      -0.00000000       0.37878788 1.0 
      0.36363636       0.00000000       0.36363636 1.0 
      0.34848485       0.00000000       0.34848485 1.0 
      0.33333333      -0.00000000       0.33333333 1.0 
      0.31818182       0.00000000       0.31818182 1.0 
      0.30303030      -0.00000000       0.30303030 1.0 
      0.28787879      -0.00000000       0.28787879 1.0 
      0.27272727       0.00000000       0.27272727 1.0 
      0.25757576       0.00000000       0.25757576 1.0 
      0.24242424      -0.00000000       0.24242424 1.0 
      0.22727273       0.00000000       0.22727273 1.0 
      0.21212121      -0.00000000       0.21212121 1.0 
      0.19696970       0.00000000       0.19696970 1.0 
      0.18181818       0.00000000       0.18181818 1.0 
      0.16666667      -0.00000000       0.16666667 1.0 
      0.15151515       0.00000000       0.15151515 1.0 
      0.13636364      -0.00000000       0.13636364 1.0 
      0.12121212      -0.00000000       0.12121212 1.0 
      0.10606061      -0.00000000       0.10606061 1.0 
      0.09090909      -0.00000000       0.09090909 1.0 
      0.07575758      -0.00000000       0.07575758 1.0 
      0.06060606       0.00000000       0.06060606 1.0 
      0.04545455       0.00000000       0.04545455 1.0 
      0.03030303       0.00000000       0.03030303 1.0 
      0.01515152      -0.00000000       0.01515152 1.0 
      0.00000000       0.00000000       0.00000000 1.0 

