! Pwscf input file created with ciftopw.py 
! Compound: K2Ag4S3
&control
         calculation     = 'bands'
         prefix          = 'K2Ag4S3'
         restart_mode    = 'from_scratch'
         outdir          = './'
         wf_collect      = .true.
         verbosity       = 'high'
       /
&system
         ibrav           =  14
         celldm(1)       =           16.8976064533980548
         celldm(2)       =            1.0000000000000000
         celldm(3)       =            1.2976092626395412
         celldm(4)       =            0.3051200196044906
         celldm(5)       =            0.3051200196044906
         celldm(6)       =            0.8845893627099120
         nat             =       18
         ntyp            =        3
         ecutwfc         =       46.00000000
         ecutrho         =      278.00000000
         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
 S  32.0650 S.rel-pbe-n-rrkjus_psl.1.0.0.UPF 
 K  39.0983 K.rel-pbe-spn-rrkjus_psl.1.0.0.UPF 
Ag 107.8682 Ag.rel-pbe-n-rrkjus_psl.1.0.0.UPF 
ATOMIC_POSITIONS crystal
K_POINTS crystal
289
      0.00000000       0.00000000       0.00000000 1.0 
      0.02500000       0.02500000       0.00000000 1.0 
      0.05000000       0.05000000       0.00000000 1.0 
      0.07500000       0.07500000       0.00000000 1.0 
      0.10000000       0.10000000       0.00000000 1.0 
      0.12500000       0.12500000       0.00000000 1.0 
      0.15000000       0.15000000       0.00000000 1.0 
      0.17500000       0.17500000       0.00000000 1.0 
      0.20000000       0.20000000       0.00000000 1.0 
      0.22500000       0.22500000       0.00000000 1.0 
      0.25000000       0.25000000       0.00000000 1.0 
      0.27500000       0.27500000       0.00000000 1.0 
      0.30000000       0.30000000       0.00000000 1.0 
      0.32500000       0.32500000       0.00000000 1.0 
      0.35000000       0.35000000       0.00000000 1.0 
      0.37500000       0.37500000       0.00000000 1.0 
      0.40000000       0.40000000       0.00000000 1.0 
      0.42500000       0.42500000       0.00000000 1.0 
      0.45000000       0.45000000       0.00000000 1.0 
      0.47500000       0.47500000       0.00000000 1.0 
      0.50000000       0.50000000       0.00000000 1.0 
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      0.50840488       0.50840488       0.03574413 1.0 
      0.51680976       0.51680976       0.07148825 1.0 
      0.52521464       0.52521464       0.10723238 1.0 
      0.53361951       0.53361951       0.14297650 1.0 
      0.54202439       0.54202439       0.17872063 1.0 
      0.55042927       0.55042927       0.21446475 1.0 
      0.55883415       0.55883415       0.25020888 1.0 
      0.56723903       0.56723903       0.28595300 1.0 
      0.57564391       0.57564391       0.32169713 1.0 
      0.57564391       0.57564391       0.32169713 1.0 
      0.56483763       0.56483763       0.34716897 1.0 
      0.55403136       0.55403136       0.37264080 1.0 
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      0.53241882       0.53241882       0.42358448 1.0 
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      0.51080627       0.51080627       0.47452816 1.0 
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      0.15676255      -0.15676255       0.50000000 1.0 
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      0.14313102      -0.14313102       0.50000000 1.0 
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      0.04089458      -0.04089458       0.50000000 1.0 
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      0.01363153      -0.01363153       0.50000000 1.0 
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      0.00000000       0.00000000       0.50000000 1.0 
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      0.02652226       0.02652226       0.51114393 1.0 
      0.05304451       0.05304451       0.52228786 1.0 
      0.07956677       0.07956677       0.53343179 1.0 
      0.10608902       0.10608902       0.54457572 1.0 
      0.13261128       0.13261128       0.55571965 1.0 
      0.15913354       0.15913354       0.56686358 1.0 
      0.18565579       0.18565579       0.57800751 1.0 
      0.21217805       0.21217805       0.58915144 1.0 
      0.23870030       0.23870030       0.60029537 1.0 
      0.26522256       0.26522256       0.61143930 1.0 
      0.29174481       0.29174481       0.62258323 1.0 
      0.31826707       0.31826707       0.63372716 1.0 
      0.34478933       0.34478933       0.64487109 1.0 
      0.37131158       0.37131158       0.65601501 1.0 
      0.39783384       0.39783384       0.66715894 1.0 
      0.42435609       0.42435609       0.67830287 1.0 
      0.50000000       0.50000000       0.00000000 1.0 
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      0.00000000       0.00000000       0.00000000 1.0 

