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Searched defs:type_j (Results 1 – 24 of 24) sorted by relevance

/dports/science/openkim-models/openkim-models-2021-01-28/model-drivers/Tersoff_LAMMPS__MD_077075034781_004/
H A Dpair_tersoff_zbl.cpp87 string type_i, type_j, type_k; in read_params() local
186 const string type_j = to_spec.at(j); in prepare_params() local
227 const string type_j = to_spec.at(j); in write_params() local
H A Dpair_tersoff.cpp495 string type_i, type_j, type_k; in read_params() local
582 const string type_j = to_spec.at(j); in prepare_params() local
692 const string type_j = to_spec.at(j); in write_params() local
/dports/science/lammps/lammps-stable_29Sep2021/src/REAXFF/
H A Dreaxff_bonds.cpp39 int type_i, type_j; in Bonds() local
H A Dreaxff_forces.cpp132 int type_i, type_j; in Init_Forces_noQEq() local
257 int type_i, type_j; in Estimate_Storages() local
H A Dreaxff_hydrogen_bonds.cpp38 int type_i, type_j, type_k; in Hydrogen_Bonds() local
H A Dreaxff_multi_body.cpp40 int i, j, pj, type_i, type_j; in Atom_Energy() local
H A Dreaxff_bond_orders.cpp247 int i, j, pj, type_i, type_j; in BO() local
H A Dreaxff_nonbonded.cpp218 int type_i, type_j, tmin, tmax; in Tabulated_vdW_Coulomb_Energy() local
H A Dreaxff_valence_angles.cpp74 int type_i, type_j, type_k; in Valence_Angles() local
H A Dreaxff_torsion_angles.cpp122 int type_i, type_j, type_k, type_l; in Torsion_Angles() local
/dports/science/lammps/lammps-stable_29Sep2021/src/OPENMP/
H A Dreaxff_bonds_omp.cpp59 int type_i, type_j; in BondsOMP() local
H A Dreaxff_hydrogen_bonds_omp.cpp56 int type_i, type_j, type_k; in Hydrogen_BondsOMP() local
H A Dreaxff_multi_body_omp.cpp66 int i, j, pj, type_i, type_j; in Atom_EnergyOMP() local
H A Dreaxff_nonbonded_omp.cpp244 int type_i, type_j, tmin, tmax; in Tabulated_vdW_Coulomb_Energy_OMP() local
H A Dreaxff_forces_omp.cpp226 int type_i, type_j; in Init_Forces_noQEq_OMP() local
H A Dreaxff_bond_orders_omp.cpp249 int i, j, pj, type_i, type_j; in BOOMP() local
H A Dreaxff_torsion_angles_omp.cpp65 int type_i, type_j, type_k, type_l; in Torsion_AnglesOMP() local
H A Dreaxff_valence_angles_omp.cpp124 int type_i, type_j, type_k; in Valence_AnglesOMP() local
/dports/science/libefp/libefp-1.5.0/src/
H A Dint.c234 init_ft(size_t count_i, char type_j, double *ft) in init_ft()
310 size_t type_j = get_shell_idx(sh_j->type); in efp_st_int() local
469 size_t type_j = get_shell_idx(sh_j->type); in efp_st_int_deriv() local
/dports/devel/tigcc/tigcc-0.96.b8_10/gnu/gcc-4.1-20060728/gcc/
H A Dcfgexpand.c323 tree type_j = TREE_TYPE (stack_vars[j].decl); in add_alias_set_conflicts() local
/dports/science/gromacs/gromacs-2021.4/src/gromacs/gmxpreprocess/
H A Dtoppush.cpp1680 int type_j, in natom_match()
/dports/science/nwchem-data/nwchem-7.0.2-release/src/NWints/auxil/
H A Dint_spcart.F2699 & type_j,type_i, argument
2723 integer type_j, type_i ! [input] angular momentem for j and i local
/dports/science/nwchem/nwchem-7b21660b82ebd85ef659f6fba7e1e73433b0bd0a/src/NWints/auxil/
H A Dint_spcart.F2699 & type_j,type_i, argument
2723 integer type_j, type_i ! [input] angular momentem for j and i local
/dports/misc/opennn/opennn-5.0.5/opennn/
H A Ddata_set.cpp5921 const ColumnType type_j = columns(current_input_index_j).type; in calculate_input_columns_correlations() local