mech2d.scripts package

Submodules

mech2d.scripts.cvasp module

mech2d.scripts.cvasp.main()

mech2d.scripts.cvasp.relaxation_static_run(vasp_cmd, half_kpts_first_relax=False, auto_npar=True, backup=False, auto_continue=False)

mech2d.scripts.cvasp.runvasp(cmd, max_errors=3, half_kpts_first_relax=True, auto_npar=True)

cmd example: cmd=[‘mpirun’, ‘-np’, ‘48’ , ‘/opt/soft/vasp541/vasp_fix_z_intel2015’]