INPUT_PARAMETERS
suffix d4
calculation scf
basis_type pw
ntype 2
nspin 1
nelec 16
nbands 12
ecutwfc 40
scf_thr 1e-6
scf_nmax 160
dft_functional pbe
ks_solver cg
symmetry -1
smearing_method fixed
mixing_type broyden
mixing_beta 0.3
cal_force 1
cal_stress 1
out_chg 0
vdw_method d4
vdw_d4_xc pbe
vdw_d4_model d4
vdw_cutoff_radius 95
vdw_radius_unit Bohr
vdw_cn_thr 40
vdw_cn_thr_unit Bohr
vdw_cutoff_width2 0
vdw_cutoff_width3 0
