Functions | |
| subroutine, public | list_control (atomic_kind_set, particle_set, local_particles, cell, fist_nonbond_env, para_env, mm_section, shell_particle_set, core_particle_set, force_update, exclusions, error) |
Variables | |
| CHARACTER(len=*), parameter, private | moduleN = 'fist_neighbor_list_control' |
Detailed Description
- History
- Harald Forbert (Dec-2000): Changes for multiple linked lists linklist_internal_data_type 07.02.2005: using real coordinates for r_last_update; cleaned (MK)
Function Documentation
| subroutine,public fist_neighbor_list_control::list_control | ( | TYPE(atomic_kind_type),dimension(:),pointer | atomic_kind_set, |
| TYPE(particle_type),dimension(:),pointer | particle_set, | ||
| TYPE(distribution_1d_type),pointer | local_particles, | ||
| TYPE(cell_type),pointer | cell, | ||
| TYPE(fist_nonbond_env_type),pointer | fist_nonbond_env, | ||
| TYPE(cp_para_env_type),pointer | para_env, | ||
| TYPE(section_vals_type),pointer | mm_section, | ||
| TYPE(particle_type),dimension(:),optional,pointer | shell_particle_set, | ||
| TYPE(particle_type),dimension(:),optional,pointer | core_particle_set, | ||
| LOGICAL,intent(in),optional | force_update, | ||
| TYPE(exclusion_type),dimension(:),optional | exclusions, | ||
| TYPE(cp_error_type),intent(inout) | error | ||
| ) |
Definition at line 63 of file fist_neighbor_list_control.f90.
References fist_neighbor_lists::build_fist_neighbor_lists(), cell, cell_types::cell_clone(), cp_output_handling::cp_print_key_finished_output(), CPPostcondition, error, fist_nonbond_env_types::fist_nonbond_env_get(), and timings::timeset().
Referenced by se_fock_matrix_coulomb_mpi::build_fock_matrix_coulomb_lr(), se_fock_matrix_coulomb_ga::build_fock_matrix_coulomb_lr(), debug_ewald_multipoles_fields(), and fist_force::fist_force_control().
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Variable Documentation
| CHARACTER(len=*),parameter,private fist_neighbor_list_control::moduleN = 'fist_neighbor_list_control' |
Definition at line 49 of file fist_neighbor_list_control.f90.
