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occ::mults::ForceFieldParams Member List

This is the complete list of members for occ::mults::ForceFieldParams, including all inherited members.

bonded_neighbors(const std::vector< int > &atomic_numbers, const std::vector< Vec3 > &positions)occ::mults::ForceFieldParamsstatic
classify_williams_type(int idx, const std::vector< std::vector< int > > &neighbors, const std::vector< int > &atomic_numbers)occ::mults::ForceFieldParamsstatic
clear_typed_buckingham()occ::mults::ForceFieldParams
get_aniso(int type1, int type2) constocc::mults::ForceFieldParams
get_buckingham(int Z1, int Z2) constocc::mults::ForceFieldParams
get_buckingham_for_types(int type1, int type2) constocc::mults::ForceFieldParams
get_typed_buckingham(int type1, int type2) constocc::mults::ForceFieldParams
has_aniso(int type1, int type2) constocc::mults::ForceFieldParams
has_any_aniso() constocc::mults::ForceFieldParamsinline
has_buckingham(int Z1, int Z2) constocc::mults::ForceFieldParams
has_typed_buckingham(int type1, int type2) constocc::mults::ForceFieldParams
lj_params() constocc::mults::ForceFieldParamsinline
set_buckingham(int Z1, int Z2, const BuckinghamParams &p)occ::mults::ForceFieldParams
set_type_labels(const std::map< int, std::string > &labels)occ::mults::ForceFieldParams
set_typed_aniso(const std::map< std::pair< int, int >, AnisotropicRepulsionParams > &params)occ::mults::ForceFieldParams
set_typed_buckingham(int type1, int type2, const BuckinghamParams &p)occ::mults::ForceFieldParams
set_typed_buckingham(const std::map< std::pair< int, int >, BuckinghamParams > &params)occ::mults::ForceFieldParams
set_use_short_range_typing(bool v)occ::mults::ForceFieldParamsinline
set_use_williams_atom_typing(bool v)occ::mults::ForceFieldParamsinline
short_range_type_atomic_number(int type_code)occ::mults::ForceFieldParamsstatic
short_range_type_label(int type_code)occ::mults::ForceFieldParamsstatic
type_name(int type_code) constocc::mults::ForceFieldParams
use_short_range_typing() constocc::mults::ForceFieldParamsinline
use_williams_atom_typing() constocc::mults::ForceFieldParamsinline
williams_de_params()occ::mults::ForceFieldParamsstatic
williams_typed_params()occ::mults::ForceFieldParamsstatic