INPUT_PARAMETERS
suffix    autotest
nbands    40

calculation    scf
ecutwfc    10
scf_thr    1.0e-4
scf_nmax    50
out_chg    0

#init_chg    file
#out_dos    1
#dos_sigma    0.05
#out_band    1

smearing_method    gaussian
smearing_sigma    0.01

#force_thr_ev    0.01
#relax_method    cg
#relax_bfgs_init    0.5

mixing_type    pulay
mixing_beta    0.3
mixing_restart 1e-3
mixing_dmr     1
mixing_gg0    1.1

ks_solver    dav_subspace
diago_smooth_ethr true
pw_diag_ndim  2
basis_type    pw
gamma_only    0
noncolin    1
lspinorb    1
cal_force   1
cal_stress  1

#Parameter DFT+U
dft_plus_u    1
orbital_corr    2 
hubbard_u    5.0 
onsite_radius   3.0
pseudo_dir	../../PP_ORB
orbital_dir	../../PP_ORB

pw_seed 1
