(git:ccc2433)
manybody_gal.F File Reference

Go to the source code of this file.

Modules

module  manybody_gal
 Implementation of the GAL19 potential.
 

Functions/Subroutines

subroutine, public manybody_gal::gal_energy (pot_loc, gal, r_last_update_pbc, iparticle, jparticle, cell, particle_set, mm_section)
 Main part of the energy evaluation of GAL19. More...
 
subroutine, public manybody_gal::gal_forces (gal, r_last_update_pbc, iparticle, jparticle, f_nonbond, use_virial, cell, particle_set)
 forces generated by the GAL19 potential More...
 
subroutine, public manybody_gal::setup_gal_arrays (nonbonded, potparm, glob_loc_list, glob_cell_v, glob_loc_list_a, cell)
 ... More...
 
subroutine, public manybody_gal::destroy_gal_arrays (glob_loc_list, glob_cell_v, glob_loc_list_a)
 ... More...
 
subroutine, public manybody_gal::print_nr_ions_gal (nr_ions, mm_section, para_env, print_oh, print_h3o, print_o)
 prints the number of OH- ions or H3O+ ions near surface More...