INPUT_PARAMETERS
suffix nac
calculation md
basis_type lcao
ntype 2
ecutwfc 60
scf_thr 1e-6
scf_nmax 120
dft_functional pbe
gamma_only 1
ks_solver genelpa
nbands 8
smearing_method fixed
mixing_type broyden
mixing_beta 0.3
cal_force 1
cal_stress 0
out_chg 0
out_wfc_lcao 1
out_mat_hs 1 12
cal_syns 1 12
md_type nve
md_dt 0.25
md_nstep 16
md_tfirst 300
md_seed 69917
md_dumpfreq 1
md_restartfreq 4
