(git:c5411e0)
|
Data Fields | |
integer | lri_overlap_inv |
logical | debug |
logical | use_shg_integrals |
real(kind=dp) | cond_max |
real(kind=dp) | delta |
real(kind=dp) | eps_o3_int |
type(gto_basis_set_p_type), dimension(:), pointer | orb_basis |
type(gto_basis_set_p_type), dimension(:), pointer | ri_basis |
type(neighbor_list_set_p_type), dimension(:), pointer | soo_list |
type(neighbor_list_set_p_type), dimension(:), pointer | saa_list |
type(neighbor_list_set_p_type), dimension(:), pointer | soa_list |
type(lri_list_type), pointer | lri_ints |
type(lri_ppl_int_type), pointer | lri_ppl_ints |
type(lri_list_type), pointer | lri_ints_rho |
type(lri_bas_type), dimension(:), pointer | bas_prop |
type(lri_clebsch_gordon_type), pointer | cg_shg |
type(dbcsr_p_type), dimension(:), pointer | ob_smat |
logical | statistics |
type(stat_type) | stat |
logical | exact_1c_terms |
logical | ppl_ri |
logical | store_integrals |
logical | distant_pair_approximation |
character(len=10) | distant_pair_method |
real(kind=dp) | r_in |
real(kind=dp) | r_out |
real(kind=dp), dimension(:), pointer | aradius |
type(wbas_type), dimension(:), pointer | wbas |
type(wmat_type), dimension(:, :), pointer | wmat |
type(dbcsr_p_type), dimension(:), pointer | ri_smat |
type(dbcsr_p_type), dimension(:), pointer | ri_sinv |
type(ri_fit_type), pointer | ri_fit |
character(len=10) | ri_sinv_app |
type(o3c_container_type), pointer | o3c |
Definition at line 269 of file lri_environment_types.F.
integer lri_environment_types::lri_environment_type::lri_overlap_inv |
Definition at line 271 of file lri_environment_types.F.
logical lri_environment_types::lri_environment_type::debug |
Definition at line 273 of file lri_environment_types.F.
logical lri_environment_types::lri_environment_type::use_shg_integrals |
Definition at line 275 of file lri_environment_types.F.
real(kind=dp) lri_environment_types::lri_environment_type::cond_max |
Definition at line 278 of file lri_environment_types.F.
real(kind=dp) lri_environment_types::lri_environment_type::delta |
Definition at line 280 of file lri_environment_types.F.
real(kind=dp) lri_environment_types::lri_environment_type::eps_o3_int |
Definition at line 282 of file lri_environment_types.F.
type(gto_basis_set_p_type), dimension(:), pointer lri_environment_types::lri_environment_type::orb_basis |
Definition at line 284 of file lri_environment_types.F.
type(gto_basis_set_p_type), dimension(:), pointer lri_environment_types::lri_environment_type::ri_basis |
Definition at line 286 of file lri_environment_types.F.
type(neighbor_list_set_p_type), dimension(:), pointer lri_environment_types::lri_environment_type::soo_list |
Definition at line 288 of file lri_environment_types.F.
type(neighbor_list_set_p_type), dimension(:), pointer lri_environment_types::lri_environment_type::saa_list |
Definition at line 289 of file lri_environment_types.F.
type(neighbor_list_set_p_type), dimension(:), pointer lri_environment_types::lri_environment_type::soa_list |
Definition at line 290 of file lri_environment_types.F.
type(lri_list_type), pointer lri_environment_types::lri_environment_type::lri_ints |
Definition at line 292 of file lri_environment_types.F.
type(lri_ppl_int_type), pointer lri_environment_types::lri_environment_type::lri_ppl_ints |
Definition at line 294 of file lri_environment_types.F.
type(lri_list_type), pointer lri_environment_types::lri_environment_type::lri_ints_rho |
Definition at line 296 of file lri_environment_types.F.
type(lri_bas_type), dimension(:), pointer lri_environment_types::lri_environment_type::bas_prop |
Definition at line 298 of file lri_environment_types.F.
type(lri_clebsch_gordon_type), pointer lri_environment_types::lri_environment_type::cg_shg |
Definition at line 300 of file lri_environment_types.F.
type(dbcsr_p_type), dimension(:), pointer lri_environment_types::lri_environment_type::ob_smat |
Definition at line 302 of file lri_environment_types.F.
logical lri_environment_types::lri_environment_type::statistics |
Definition at line 304 of file lri_environment_types.F.
type(stat_type) lri_environment_types::lri_environment_type::stat |
Definition at line 305 of file lri_environment_types.F.
logical lri_environment_types::lri_environment_type::exact_1c_terms |
Definition at line 307 of file lri_environment_types.F.
logical lri_environment_types::lri_environment_type::ppl_ri |
Definition at line 309 of file lri_environment_types.F.
logical lri_environment_types::lri_environment_type::store_integrals |
Definition at line 311 of file lri_environment_types.F.
logical lri_environment_types::lri_environment_type::distant_pair_approximation |
Definition at line 313 of file lri_environment_types.F.
character(len=10) lri_environment_types::lri_environment_type::distant_pair_method |
Definition at line 314 of file lri_environment_types.F.
real(kind=dp) lri_environment_types::lri_environment_type::r_in |
Definition at line 315 of file lri_environment_types.F.
real(kind=dp) lri_environment_types::lri_environment_type::r_out |
Definition at line 316 of file lri_environment_types.F.
real(kind=dp), dimension(:), pointer lri_environment_types::lri_environment_type::aradius |
Definition at line 317 of file lri_environment_types.F.
type(wbas_type), dimension(:), pointer lri_environment_types::lri_environment_type::wbas |
Definition at line 318 of file lri_environment_types.F.
type(wmat_type), dimension(:, :), pointer lri_environment_types::lri_environment_type::wmat |
Definition at line 319 of file lri_environment_types.F.
type(dbcsr_p_type), dimension(:), pointer lri_environment_types::lri_environment_type::ri_smat |
Definition at line 321 of file lri_environment_types.F.
type(dbcsr_p_type), dimension(:), pointer lri_environment_types::lri_environment_type::ri_sinv |
Definition at line 321 of file lri_environment_types.F.
type(ri_fit_type), pointer lri_environment_types::lri_environment_type::ri_fit |
Definition at line 323 of file lri_environment_types.F.
character(len=10) lri_environment_types::lri_environment_type::ri_sinv_app |
Definition at line 324 of file lri_environment_types.F.
type(o3c_container_type), pointer lri_environment_types::lri_environment_type::o3c |
Definition at line 325 of file lri_environment_types.F.