INPUT_PARAMETERS
#Parameters (1.General)
suffix                  abacus
calculation             md
ntype                   2
nbands                  6
symmetry                0

#Parameters (2.Iteration)
ecutwfc                 50
scf_thr                     1e-2
scf_nmax                   50

#Parameters (3.Basis)
basis_type              lcao 
gamma_only              1

#Parameters (4.Smearing)
smearing_method                gaussian
smearing_sigma                   0.02

#Parameters (5.Mixing)
mixing_type             pulay
mixing_beta             0.4

#Parameters (6.Deepks)
#cal_force			1
#test_force			1
#deepks_out_labels          1
#deepks_descriptor_lmax			2
#deepks_scf	1
#deepks_model	model.ptg

md_type          1
md_dt              0.1
md_tfirst          300
md_tfreq           0.1
md_restart           0
md_dumpfreq          5
md_nstep               20
out_level           m

cal_stress 1
