
&CONTROL
  calculation='nscf',
  outdir='.',
  prefix='g_fe_pd_11',
  pseudo_dir='.',
  verbosity='low',
/

&SYSTEM
  ibrav=14,
  celldm(1)=18.6039757511d0, celldm(2)=1.0000000000d0, celldm(3)=1.5236470015d0,
  celldm(4)=0.0000000000d0, celldm(5)=0.0000000000d0, celldm(6)=-0.5000000000d0,
  nat=40,
  ntyp=3,
  ecutwfc=40,
  ecutrho=400,
  input_dft='pbe',
  vdw_corr='grimme-d2',
  occupations='smearing',
  smearing='mv',
  degauss=0.005d0,
/

&ELECTRONS
  conv_thr=1d-06,
  mixing_beta=0.7d0,
/

ATOMIC_SPECIES
  C 12.010700d0 C.pbe-n-rrkjus_psl.0.1.UPF
  Fe 55.845000d0 Fe.pbe-nd-rrkjus.UPF
  Pd 106.420000d0 Pd.pbe-n-rrkjus_psl.0.2.2.UPF

ATOMIC_POSITIONS {crystal}
   C   0.0833333000d0   0.0416667000d0   0.0000000000d0
   C   0.0833333000d0   0.2916670000d0   0.0000000000d0
   C   0.0833333000d0   0.5416670000d0   0.0000000000d0
   C   0.0833333000d0   0.7916670000d0   0.0000000000d0
   C   0.3333330000d0   0.0416667000d0   0.0000000000d0
   C   0.3333330000d0   0.2916670000d0   0.0000000000d0
   C   0.3333330000d0   0.5416670000d0   0.0000000000d0
   C   0.3333330000d0   0.7916670000d0   0.0000000000d0
   C   0.5833330000d0   0.0416667000d0   0.0000000000d0
   C   0.5833330000d0   0.2916670000d0   0.0000000000d0
   C   0.5833330000d0   0.5416670000d0   0.0000000000d0
   C   0.5833330000d0   0.7916670000d0   0.0000000000d0
   C   0.8333330000d0   0.0416667000d0   0.0000000000d0
   C   0.8333330000d0   0.2916670000d0   0.0000000000d0
   C   0.8333330000d0   0.5416670000d0   0.0000000000d0
   C   0.8333330000d0   0.7916670000d0   0.0000000000d0
   C   0.1666670000d0   0.2083330000d0   0.0000000000d0
   C   0.1666670000d0   0.4583330000d0   0.0000000000d0
   C   0.1666670000d0   0.7083330000d0   0.0000000000d0
   C   0.1666670000d0   0.9583330000d0   0.0000000000d0
   C   0.4166670000d0   0.2083330000d0   0.0000000000d0
   C   0.4166670000d0   0.4583330000d0   0.0000000000d0
   C   0.4166670000d0   0.7083330000d0   0.0000000000d0
   C   0.4166670000d0   0.9583330000d0   0.0000000000d0
   C   0.6666670000d0   0.2083330000d0   0.0000000000d0
   C   0.6666670000d0   0.4583330000d0   0.0000000000d0
   C   0.6666670000d0   0.7083330000d0   0.0000000000d0
   C   0.6666670000d0   0.9583330000d0   0.0000000000d0
   C   0.9166670000d0   0.2083330000d0   0.0000000000d0
   C   0.9166670000d0   0.4583330000d0   0.0000000000d0
   C   0.9166670000d0   0.7083330000d0   0.0000000000d0
   C   0.9166670000d0   0.9583330000d0   0.0000000000d0
  Pd   0.3400350000d0   0.4248010000d0   0.0747534000d0
  Pd   0.5871980000d0   0.7279920000d0   0.0747534000d0
  Pd   0.4089030000d0   0.6055090000d0   0.2260260000d0
  Pd   0.2840900000d0   0.6719210000d0   0.0795636000d0
  Fe   0.5366974299d0   0.3597197628d0   0.0751043857d0
  Fe   0.7266702593d0   0.6457672838d0   0.0774626964d0
  Fe   0.7633130327d0   0.5219593988d0   0.2125702216d0
  Fe   0.8080075296d0   0.4039159389d0   0.0774626964d0

K_POINTS {automatic}
  27 27 1 0 0 0

