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subroutine, public | manybody_tersoff::tersoff_energy (pot_loc, tersoff, r_last_update_pbc, atom_a, atom_b, nloc_size, full_loc_list, loc_cell_v, cell_v, drij) |
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subroutine, public | manybody_tersoff::tersoff_forces (tersoff, r_last_update_pbc, cell_v, n_loc_size, full_loc_list, loc_cell_v, iparticle, jparticle, f_nonbond, pv_nonbond, use_virial, rcutsq) |
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subroutine, public | manybody_tersoff::setup_tersoff_arrays (nonbonded, potparm, glob_loc_list, glob_cell_v, glob_loc_list_a, cell) |
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subroutine, public | manybody_tersoff::destroy_tersoff_arrays (glob_loc_list, glob_cell_v, glob_loc_list_a) |
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