INPUT_PARAMETERS
suffix tutorial
calculation md
basis_type pw
ecutwfc 40
scf_thr 1e-8
scf_nmax 150
ks_solver cg
device gpu
precision double
cal_force 1
cal_stress 1
pseudo_dir /public/.ys-abacus-tutorials-20261027/PP_ORB
orbital_dir /public/.ys-abacus-tutorials-20261027/PP_ORB
md_type nve
md_nstep 30
md_dt 0.5
md_tfirst 300
md_seed 12345
