INPUT_PARAMETERS
suffix nep
calculation md
esolver_type nep
pot_file nep.txt
ntype 1
basis_type pw
cal_force 1
cal_stress 1
md_type nvt
md_thermostat nhc
md_nstep 80
md_dt 0.5
md_tfirst 300
md_tlast 300
md_seed 6741
init_vel 0
md_dumpfreq 1
md_restartfreq 5
md_out_force 0
dump_force 1
dump_vel 1
