rmc_init.py
rmc_dat.init()
CONTINUE_NUMBERED_INIT
rmc_vasp_init.py
VaspIncar.init()
False
True
manual_sequence
continue_rmc_dft
RmcPotDatTop
[ moleculetype ]
[ atoms ]
[ pairs ]
[ bonds ]
[ angles ]
[ system ]
[ molecules ]
add_molecule_template()
first_instance_indices
second_instance_indices
validate_rmc_index_progression()
add_explicit_network_molecule()
RmcPotDatFnc
validate()