INPUT_PARAMETERS
suffix td
calculation md
esolver_type tdofdft
basis_type pw
ntype 2
nspin 1
nelec 12
ecutwfc 44
scf_nmax 160
symmetry 0
cal_force 1
cal_stress 1
pseudo_rcut 16
of_kinetic tf+
of_method tn
of_conv energy
of_tole 1e-6
of_full_pw 1
of_full_pw_dim 1
out_chg 1 12
nbspline 10
of_cd 1
of_mcd_alpha 1
init_vel 1
init_chg file
read_file_dir ./
md_restart 0
md_type nve
md_nstep 1
md_dt 0.0005
md_dumpfreq 1
md_restartfreq 0
dump_force 1
dump_vel 1
md_out_force 0
nx 45
ny 45
nz 45
