INPUT_PARAMETERS
#Parameters (General)
suffix              autotest

calculation         md
pseudo_dir          ../../PP_ORB

#Parameters (esolver)
esolver_type        lj
lj_rcut             8.5
lj_epsilon          0.01032
lj_sigma            3.405

cal_force           1
cal_stress          1

#Parameters (MD)
md_nstep            14
md_type             nvt
md_dt               1
md_tfirst           300
md_restart          1
init_vel            1

#Parameters (thermostat)
md_thermostat       rescale_v
md_nraise           2
