! Pwscf input file created with ciftopw.py 
! Compound: NaLi2AsO4
&control
         calculation     = 'bands'
         prefix          = 'NaLi2AsO4'
         restart_mode    = 'from_scratch'
         outdir          = './'
         wf_collect      = .true.
         verbosity       = 'high'
       /
&system
         ibrav           =  14
         celldm(1)       =            9.5506751484060004
         celldm(2)       =            1.0298773248911752
         celldm(3)       =            1.3907795805302730
         celldm(4)       =            0.0000000000000001
         celldm(5)       =            0.0000000000000001
         celldm(6)       =            0.0000000000000001
         nat             =       16
         ntyp            =        4
         ecutwfc         =      103.00000000
         ecutrho         =      412.00000000
         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 
As  74.9216 As.rel-pbe-n-rrkjus_psl.1.0.0.UPF 
Na  22.9898 Na.rel-pbe-spnl-rrkjus_psl.1.0.0.UPF 
Li   6.9410 Li.rel-pbe-s-rrkjus_psl.1.0.0.UPF 
ATOMIC_POSITIONS crystal
K_POINTS crystal
356
      0.00000000       0.00000000       0.00000000 1.0 
      0.01562500       0.00000000       0.00000000 1.0 
      0.03125000       0.00000000       0.00000000 1.0 
      0.04687500       0.00000000       0.00000000 1.0 
      0.06250000       0.00000000       0.00000000 1.0 
      0.07812500       0.00000000       0.00000000 1.0 
      0.09375000       0.00000000       0.00000000 1.0 
      0.10937500       0.00000000       0.00000000 1.0 
      0.12500000       0.00000000       0.00000000 1.0 
      0.14062500       0.00000000       0.00000000 1.0 
      0.15625000       0.00000000       0.00000000 1.0 
      0.17187500       0.00000000       0.00000000 1.0 
      0.18750000       0.00000000       0.00000000 1.0 
      0.20312500       0.00000000       0.00000000 1.0 
      0.21875000       0.00000000       0.00000000 1.0 
      0.23437500       0.00000000       0.00000000 1.0 
      0.25000000       0.00000000       0.00000000 1.0 
      0.26562500       0.00000000       0.00000000 1.0 
      0.28125000       0.00000000       0.00000000 1.0 
      0.29687500       0.00000000       0.00000000 1.0 
      0.31250000       0.00000000       0.00000000 1.0 
      0.32812500       0.00000000       0.00000000 1.0 
      0.34375000       0.00000000       0.00000000 1.0 
      0.35937500       0.00000000       0.00000000 1.0 
      0.37500000       0.00000000       0.00000000 1.0 
      0.39062500       0.00000000       0.00000000 1.0 
      0.40625000       0.00000000       0.00000000 1.0 
      0.42187500       0.00000000       0.00000000 1.0 
      0.43750000       0.00000000       0.00000000 1.0 
      0.45312500       0.00000000       0.00000000 1.0 
      0.46875000       0.00000000       0.00000000 1.0 
      0.48437500       0.00000000       0.00000000 1.0 
      0.50000000       0.00000000       0.00000000 1.0 
      0.50000000       0.00000000       0.00000000 1.0 
      0.50000000       0.01612903       0.00000000 1.0 
      0.50000000       0.03225806       0.00000000 1.0 
      0.50000000       0.04838710       0.00000000 1.0 
      0.50000000       0.06451613       0.00000000 1.0 
      0.50000000       0.08064516       0.00000000 1.0 
      0.50000000       0.09677419       0.00000000 1.0 
      0.50000000       0.11290323       0.00000000 1.0 
      0.50000000       0.12903226       0.00000000 1.0 
      0.50000000       0.14516129       0.00000000 1.0 
      0.50000000       0.16129032       0.00000000 1.0 
      0.50000000       0.17741935       0.00000000 1.0 
      0.50000000       0.19354839       0.00000000 1.0 
      0.50000000       0.20967742       0.00000000 1.0 
      0.50000000       0.22580645       0.00000000 1.0 
      0.50000000       0.24193548       0.00000000 1.0 
      0.50000000       0.25806452       0.00000000 1.0 
      0.50000000       0.27419355       0.00000000 1.0 
      0.50000000       0.29032258       0.00000000 1.0 
      0.50000000       0.30645161       0.00000000 1.0 
      0.50000000       0.32258065       0.00000000 1.0 
      0.50000000       0.33870968       0.00000000 1.0 
      0.50000000       0.35483871       0.00000000 1.0 
      0.50000000       0.37096774       0.00000000 1.0 
      0.50000000       0.38709677       0.00000000 1.0 
      0.50000000       0.40322581       0.00000000 1.0 
      0.50000000       0.41935484       0.00000000 1.0 
      0.50000000       0.43548387       0.00000000 1.0 
      0.50000000       0.45161290       0.00000000 1.0 
      0.50000000       0.46774194       0.00000000 1.0 
      0.50000000       0.48387097       0.00000000 1.0 
      0.50000000       0.50000000       0.00000000 1.0 
      0.50000000       0.50000000       0.00000000 1.0 
      0.48437500       0.50000000       0.00000000 1.0 
      0.46875000       0.50000000       0.00000000 1.0 
      0.45312500       0.50000000       0.00000000 1.0 
      0.43750000       0.50000000       0.00000000 1.0 
      0.42187500       0.50000000       0.00000000 1.0 
      0.40625000       0.50000000       0.00000000 1.0 
      0.39062500       0.50000000       0.00000000 1.0 
      0.37500000       0.50000000       0.00000000 1.0 
      0.35937500       0.50000000       0.00000000 1.0 
      0.34375000       0.50000000       0.00000000 1.0 
      0.32812500       0.50000000       0.00000000 1.0 
      0.31250000       0.50000000       0.00000000 1.0 
      0.29687500       0.50000000       0.00000000 1.0 
      0.28125000       0.50000000       0.00000000 1.0 
      0.26562500       0.50000000       0.00000000 1.0 
      0.25000000       0.50000000       0.00000000 1.0 
      0.23437500       0.50000000       0.00000000 1.0 
      0.21875000       0.50000000       0.00000000 1.0 
      0.20312500       0.50000000       0.00000000 1.0 
      0.18750000       0.50000000       0.00000000 1.0 
      0.17187500       0.50000000       0.00000000 1.0 
      0.15625000       0.50000000       0.00000000 1.0 
      0.14062500       0.50000000       0.00000000 1.0 
      0.12500000       0.50000000       0.00000000 1.0 
      0.10937500       0.50000000       0.00000000 1.0 
      0.09375000       0.50000000       0.00000000 1.0 
      0.07812500       0.50000000       0.00000000 1.0 
      0.06250000       0.50000000       0.00000000 1.0 
      0.04687500       0.50000000       0.00000000 1.0 
      0.03125000       0.50000000       0.00000000 1.0 
      0.01562500       0.50000000       0.00000000 1.0 
      0.00000000       0.50000000       0.00000000 1.0 
      0.00000000       0.50000000       0.00000000 1.0 
      0.00000000       0.48387097       0.00000000 1.0 
      0.00000000       0.46774194       0.00000000 1.0 
      0.00000000       0.45161290       0.00000000 1.0 
      0.00000000       0.43548387       0.00000000 1.0 
      0.00000000       0.41935484       0.00000000 1.0 
      0.00000000       0.40322581       0.00000000 1.0 
      0.00000000       0.38709677       0.00000000 1.0 
      0.00000000       0.37096774       0.00000000 1.0 
      0.00000000       0.35483871       0.00000000 1.0 
      0.00000000       0.33870968       0.00000000 1.0 
      0.00000000       0.32258065       0.00000000 1.0 
      0.00000000       0.30645161       0.00000000 1.0 
      0.00000000       0.29032258       0.00000000 1.0 
      0.00000000       0.27419355       0.00000000 1.0 
      0.00000000       0.25806452       0.00000000 1.0 
      0.00000000       0.24193548       0.00000000 1.0 
      0.00000000       0.22580645       0.00000000 1.0 
      0.00000000       0.20967742       0.00000000 1.0 
      0.00000000       0.19354839       0.00000000 1.0 
      0.00000000       0.17741935       0.00000000 1.0 
      0.00000000       0.16129032       0.00000000 1.0 
      0.00000000       0.14516129       0.00000000 1.0 
      0.00000000       0.12903226       0.00000000 1.0 
      0.00000000       0.11290323       0.00000000 1.0 
      0.00000000       0.09677419       0.00000000 1.0 
      0.00000000       0.08064516       0.00000000 1.0 
      0.00000000       0.06451613       0.00000000 1.0 
      0.00000000       0.04838710       0.00000000 1.0 
      0.00000000       0.03225806       0.00000000 1.0 
      0.00000000       0.01612903       0.00000000 1.0 
      0.00000000       0.00000000       0.00000000 1.0 
      0.00000000       0.00000000       0.00000000 1.0 
      0.00000000      -0.00000000       0.02173913 1.0 
      0.00000000      -0.00000000       0.04347826 1.0 
     -0.00000000      -0.00000000       0.06521739 1.0 
      0.00000000      -0.00000000       0.08695652 1.0 
      0.00000000      -0.00000000       0.10869565 1.0 
     -0.00000000      -0.00000000       0.13043478 1.0 
     -0.00000000       0.00000000       0.15217391 1.0 
      0.00000000      -0.00000000       0.17391304 1.0 
     -0.00000000      -0.00000000       0.19565217 1.0 
      0.00000000      -0.00000000       0.21739130 1.0 
     -0.00000000      -0.00000000       0.23913043 1.0 
     -0.00000000      -0.00000000       0.26086957 1.0 
     -0.00000000      -0.00000000       0.28260870 1.0 
     -0.00000000       0.00000000       0.30434783 1.0 
      0.00000000      -0.00000000       0.32608696 1.0 
      0.00000000      -0.00000000       0.34782609 1.0 
     -0.00000000      -0.00000000       0.36956522 1.0 
     -0.00000000      -0.00000000       0.39130435 1.0 
      0.00000000      -0.00000000       0.41304348 1.0 
      0.00000000      -0.00000000       0.43478261 1.0 
      0.00000000      -0.00000000       0.45652174 1.0 
     -0.00000000      -0.00000000       0.47826087 1.0 
     -0.00000000      -0.00000000       0.50000000 1.0 
     -0.00000000      -0.00000000       0.50000000 1.0 
      0.01562500      -0.00000000       0.50000000 1.0 
      0.03125000      -0.00000000       0.50000000 1.0 
      0.04687500      -0.00000000       0.50000000 1.0 
      0.06250000      -0.00000000       0.50000000 1.0 
      0.07812500      -0.00000000       0.50000000 1.0 
      0.09375000      -0.00000000       0.50000000 1.0 
      0.10937500      -0.00000000       0.50000000 1.0 
      0.12500000      -0.00000000       0.50000000 1.0 
      0.14062500      -0.00000000       0.50000000 1.0 
      0.15625000       0.00000000       0.50000000 1.0 
      0.17187500      -0.00000000       0.50000000 1.0 
      0.18750000      -0.00000000       0.50000000 1.0 
      0.20312500      -0.00000000       0.50000000 1.0 
      0.21875000      -0.00000000       0.50000000 1.0 
      0.23437500      -0.00000000       0.50000000 1.0 
      0.25000000      -0.00000000       0.50000000 1.0 
      0.26562500      -0.00000000       0.50000000 1.0 
      0.28125000       0.00000000       0.50000000 1.0 
      0.29687500      -0.00000000       0.50000000 1.0 
      0.31250000      -0.00000000       0.50000000 1.0 
      0.32812500       0.00000000       0.50000000 1.0 
      0.34375000      -0.00000000       0.50000000 1.0 
      0.35937500      -0.00000000       0.50000000 1.0 
      0.37500000      -0.00000000       0.50000000 1.0 
      0.39062500      -0.00000000       0.50000000 1.0 
      0.40625000      -0.00000000       0.50000000 1.0 
      0.42187500      -0.00000000       0.50000000 1.0 
      0.43750000      -0.00000000       0.50000000 1.0 
      0.45312500      -0.00000000       0.50000000 1.0 
      0.46875000      -0.00000000       0.50000000 1.0 
      0.48437500      -0.00000000       0.50000000 1.0 
      0.50000000      -0.00000000       0.50000000 1.0 
      0.50000000      -0.00000000       0.50000000 1.0 
      0.50000000       0.01612903       0.50000000 1.0 
      0.50000000       0.03225806       0.50000000 1.0 
      0.50000000       0.04838710       0.50000000 1.0 
      0.50000000       0.06451613       0.50000000 1.0 
      0.50000000       0.08064516       0.50000000 1.0 
      0.50000000       0.09677419       0.50000000 1.0 
      0.50000000       0.11290323       0.50000000 1.0 
      0.50000000       0.12903226       0.50000000 1.0 
      0.50000000       0.14516129       0.50000000 1.0 
      0.50000000       0.16129032       0.50000000 1.0 
      0.50000000       0.17741935       0.50000000 1.0 
      0.50000000       0.19354839       0.50000000 1.0 
      0.50000000       0.20967742       0.50000000 1.0 
      0.50000000       0.22580645       0.50000000 1.0 
      0.50000000       0.24193548       0.50000000 1.0 
      0.50000000       0.25806452       0.50000000 1.0 
      0.50000000       0.27419355       0.50000000 1.0 
      0.50000000       0.29032258       0.50000000 1.0 
      0.50000000       0.30645161       0.50000000 1.0 
      0.50000000       0.32258065       0.50000000 1.0 
      0.50000000       0.33870968       0.50000000 1.0 
      0.50000000       0.35483871       0.50000000 1.0 
      0.50000000       0.37096774       0.50000000 1.0 
      0.50000000       0.38709677       0.50000000 1.0 
      0.50000000       0.40322581       0.50000000 1.0 
      0.50000000       0.41935484       0.50000000 1.0 
      0.50000000       0.43548387       0.50000000 1.0 
      0.50000000       0.45161290       0.50000000 1.0 
      0.50000000       0.46774194       0.50000000 1.0 
      0.50000000       0.48387097       0.50000000 1.0 
      0.50000000       0.50000000       0.50000000 1.0 
      0.50000000       0.50000000       0.50000000 1.0 
      0.48437500       0.50000000       0.50000000 1.0 
      0.46875000       0.50000000       0.50000000 1.0 
      0.45312500       0.50000000       0.50000000 1.0 
      0.43750000       0.50000000       0.50000000 1.0 
      0.42187500       0.50000000       0.50000000 1.0 
      0.40625000       0.50000000       0.50000000 1.0 
      0.39062500       0.50000000       0.50000000 1.0 
      0.37500000       0.50000000       0.50000000 1.0 
      0.35937500       0.50000000       0.50000000 1.0 
      0.34375000       0.50000000       0.50000000 1.0 
      0.32812500       0.50000000       0.50000000 1.0 
      0.31250000       0.50000000       0.50000000 1.0 
      0.29687500       0.50000000       0.50000000 1.0 
      0.28125000       0.50000000       0.50000000 1.0 
      0.26562500       0.50000000       0.50000000 1.0 
      0.25000000       0.50000000       0.50000000 1.0 
      0.23437500       0.50000000       0.50000000 1.0 
      0.21875000       0.50000000       0.50000000 1.0 
      0.20312500       0.50000000       0.50000000 1.0 
      0.18750000       0.50000000       0.50000000 1.0 
      0.17187500       0.50000000       0.50000000 1.0 
      0.15625000       0.50000000       0.50000000 1.0 
      0.14062500       0.50000000       0.50000000 1.0 
      0.12500000       0.50000000       0.50000000 1.0 
      0.10937500       0.50000000       0.50000000 1.0 
      0.09375000       0.50000000       0.50000000 1.0 
      0.07812500       0.50000000       0.50000000 1.0 
      0.06250000       0.50000000       0.50000000 1.0 
      0.04687500       0.50000000       0.50000000 1.0 
      0.03125000       0.50000000       0.50000000 1.0 
      0.01562500       0.50000000       0.50000000 1.0 
      0.00000000       0.50000000       0.50000000 1.0 
     -0.00000000       0.50000000       0.50000000 1.0 
     -0.00000000       0.48387097       0.50000000 1.0 
     -0.00000000       0.46774194       0.50000000 1.0 
     -0.00000000       0.45161290       0.50000000 1.0 
     -0.00000000       0.43548387       0.50000000 1.0 
     -0.00000000       0.41935484       0.50000000 1.0 
     -0.00000000       0.40322581       0.50000000 1.0 
     -0.00000000       0.38709677       0.50000000 1.0 
     -0.00000000       0.37096774       0.50000000 1.0 
     -0.00000000       0.35483871       0.50000000 1.0 
     -0.00000000       0.33870968       0.50000000 1.0 
     -0.00000000       0.32258065       0.50000000 1.0 
     -0.00000000       0.30645161       0.50000000 1.0 
     -0.00000000       0.29032258       0.50000000 1.0 
     -0.00000000       0.27419355       0.50000000 1.0 
     -0.00000000       0.25806452       0.50000000 1.0 
     -0.00000000       0.24193548       0.50000000 1.0 
     -0.00000000       0.22580645       0.50000000 1.0 
     -0.00000000       0.20967742       0.50000000 1.0 
     -0.00000000       0.19354839       0.50000000 1.0 
     -0.00000000       0.17741935       0.50000000 1.0 
     -0.00000000       0.16129032       0.50000000 1.0 
     -0.00000000       0.14516129       0.50000000 1.0 
     -0.00000000       0.12903226       0.50000000 1.0 
     -0.00000000       0.11290323       0.50000000 1.0 
     -0.00000000       0.09677419       0.50000000 1.0 
     -0.00000000       0.08064516       0.50000000 1.0 
     -0.00000000       0.06451613       0.50000000 1.0 
     -0.00000000       0.04838710       0.50000000 1.0 
     -0.00000000       0.03225806       0.50000000 1.0 
     -0.00000000       0.01612903       0.50000000 1.0 
     -0.00000000       0.00000000       0.50000000 1.0 
      0.00000000       0.50000000       0.00000000 1.0 
      0.00000000       0.50000000       0.02173913 1.0 
      0.00000000       0.50000000       0.04347826 1.0 
     -0.00000000       0.50000000       0.06521739 1.0 
      0.00000000       0.50000000       0.08695652 1.0 
      0.00000000       0.50000000       0.10869565 1.0 
     -0.00000000       0.50000000       0.13043478 1.0 
     -0.00000000       0.50000000       0.15217391 1.0 
      0.00000000       0.50000000       0.17391304 1.0 
     -0.00000000       0.50000000       0.19565217 1.0 
      0.00000000       0.50000000       0.21739130 1.0 
     -0.00000000       0.50000000       0.23913043 1.0 
     -0.00000000       0.50000000       0.26086957 1.0 
     -0.00000000       0.50000000       0.28260870 1.0 
     -0.00000000       0.50000000       0.30434783 1.0 
      0.00000000       0.50000000       0.32608696 1.0 
      0.00000000       0.50000000       0.34782609 1.0 
     -0.00000000       0.50000000       0.36956522 1.0 
     -0.00000000       0.50000000       0.39130435 1.0 
      0.00000000       0.50000000       0.41304348 1.0 
      0.00000000       0.50000000       0.43478261 1.0 
      0.00000000       0.50000000       0.45652174 1.0 
     -0.00000000       0.50000000       0.47826087 1.0 
     -0.00000000       0.50000000       0.50000000 1.0 
      0.50000000      -0.00000000       0.50000000 1.0 
      0.50000000      -0.00000000       0.47826087 1.0 
      0.50000000       0.00000000       0.45652174 1.0 
      0.50000000      -0.00000000       0.43478261 1.0 
      0.50000000       0.00000000       0.41304348 1.0 
      0.50000000      -0.00000000       0.39130435 1.0 
      0.50000000      -0.00000000       0.36956522 1.0 
      0.50000000      -0.00000000       0.34782609 1.0 
      0.50000000      -0.00000000       0.32608696 1.0 
      0.50000000       0.00000000       0.30434783 1.0 
      0.50000000      -0.00000000       0.28260870 1.0 
      0.50000000      -0.00000000       0.26086957 1.0 
      0.50000000       0.00000000       0.23913043 1.0 
      0.50000000       0.00000000       0.21739130 1.0 
      0.50000000      -0.00000000       0.19565217 1.0 
      0.50000000       0.00000000       0.17391304 1.0 
      0.50000000       0.00000000       0.15217391 1.0 
      0.50000000      -0.00000000       0.13043478 1.0 
      0.50000000       0.00000000       0.10869565 1.0 
      0.50000000       0.00000000       0.08695652 1.0 
      0.50000000       0.00000000       0.06521739 1.0 
      0.50000000       0.00000000       0.04347826 1.0 
      0.50000000       0.00000000       0.02173913 1.0 
      0.50000000       0.00000000       0.00000000 1.0 
      0.50000000       0.50000000       0.00000000 1.0 
      0.50000000       0.50000000       0.02173913 1.0 
      0.50000000       0.50000000       0.04347826 1.0 
      0.50000000       0.50000000       0.06521739 1.0 
      0.50000000       0.50000000       0.08695652 1.0 
      0.50000000       0.50000000       0.10869565 1.0 
      0.50000000       0.50000000       0.13043478 1.0 
      0.50000000       0.50000000       0.15217391 1.0 
      0.50000000       0.50000000       0.17391304 1.0 
      0.50000000       0.50000000       0.19565217 1.0 
      0.50000000       0.50000000       0.21739130 1.0 
      0.50000000       0.50000000       0.23913043 1.0 
      0.50000000       0.50000000       0.26086957 1.0 
      0.50000000       0.50000000       0.28260870 1.0 
      0.50000000       0.50000000       0.30434783 1.0 
      0.50000000       0.50000000       0.32608696 1.0 
      0.50000000       0.50000000       0.34782609 1.0 
      0.50000000       0.50000000       0.36956522 1.0 
      0.50000000       0.50000000       0.39130435 1.0 
      0.50000000       0.50000000       0.41304348 1.0 
      0.50000000       0.50000000       0.43478261 1.0 
      0.50000000       0.50000000       0.45652174 1.0 
      0.50000000       0.50000000       0.47826087 1.0 
      0.50000000       0.50000000       0.50000000 1.0 

