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(git:ed6f26b)
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#include "./base/base_uses.f90"
Go to the source code of this file.
Modules | |
module | manybody_gal21 |
Implementation of the GAL21 potential. | |
Functions/Subroutines | |
subroutine, public | manybody_gal21::gal21_energy (pot_loc, gal21, r_last_update_pbc, iparticle, jparticle, cell, particle_set, mm_section) |
Main part of the energy evaluation of GAL2119. | |
subroutine, public | manybody_gal21::gal21_forces (gal21, r_last_update_pbc, iparticle, jparticle, f_nonbond, pv_nonbond, use_virial, cell, particle_set) |
forces generated by the GAL2119 potential | |
subroutine, public | manybody_gal21::setup_gal21_arrays (nonbonded, potparm, glob_loc_list, glob_cell_v, glob_loc_list_a, cell) |
... | |
subroutine, public | manybody_gal21::destroy_gal21_arrays (glob_loc_list, glob_cell_v, glob_loc_list_a) |
... | |
subroutine, public | manybody_gal21::print_nr_ions_gal21 (nr_ions, mm_section, para_env, print_oh, print_h3o, print_o) |
prints the number of OH- ions or H3O+ ions near surface | |