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(git:d18deda)
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Data Types | |
type | ewald_pw_type |
Functions/Subroutines | |
subroutine, public | ewald_pw_create (ewald_pw, ewald_env, cell, cell_ref, print_section) |
creates the structure ewald_pw_type | |
subroutine, public | ewald_pw_release (ewald_pw) |
releases the memory used by the ewald_pw | |
subroutine, public | ewald_pw_get (ewald_pw, pw_big_pool, pw_small_pool, rs_desc, poisson_env, dg) |
get the ewald_pw environment to the correct program. | |
subroutine, public | ewald_pw_set (ewald_pw, pw_big_pool, pw_small_pool, rs_desc, dg, poisson_env) |
set the ewald_pw environment to the correct program. | |
subroutine, public ewald_pw_types::ewald_pw_create | ( | type(ewald_pw_type), intent(out) | ewald_pw, |
type(ewald_environment_type), pointer | ewald_env, | ||
type(cell_type), pointer | cell, | ||
type(cell_type), pointer | cell_ref, | ||
type(section_vals_type), pointer | print_section | ||
) |
creates the structure ewald_pw_type
ewald_pw | ... |
ewald_env | ... |
cell | ... |
cell_ref | ... |
print_section | ... |
Definition at line 82 of file ewald_pw_types.F.
subroutine, public ewald_pw_types::ewald_pw_release | ( | type(ewald_pw_type), intent(inout) | ewald_pw | ) |
releases the memory used by the ewald_pw
ewald_pw | ... |
Definition at line 101 of file ewald_pw_types.F.
subroutine, public ewald_pw_types::ewald_pw_get | ( | type(ewald_pw_type), intent(in) | ewald_pw, |
type(pw_pool_type), optional, pointer | pw_big_pool, | ||
type(pw_pool_type), optional, pointer | pw_small_pool, | ||
type(realspace_grid_desc_type), optional, pointer | rs_desc, | ||
type(pw_poisson_type), optional, pointer | poisson_env, | ||
type(dg_type), optional, pointer | dg | ||
) |
get the ewald_pw environment to the correct program.
ewald_pw | ... |
pw_big_pool | ... |
pw_small_pool | ... |
rs_desc | ... |
poisson_env | ... |
dg | ... |
Definition at line 319 of file ewald_pw_types.F.
subroutine, public ewald_pw_types::ewald_pw_set | ( | type(ewald_pw_type), intent(inout) | ewald_pw, |
type(pw_pool_type), optional, pointer | pw_big_pool, | ||
type(pw_pool_type), optional, pointer | pw_small_pool, | ||
type(realspace_grid_desc_type), optional, pointer | rs_desc, | ||
type(dg_type), optional, pointer | dg, | ||
type(pw_poisson_type), optional, pointer | poisson_env | ||
) |
set the ewald_pw environment to the correct program.
ewald_pw | ... |
pw_big_pool | ... |
pw_small_pool | ... |
rs_desc | ... |
dg | ... |
poisson_env | ... |
Definition at line 345 of file ewald_pw_types.F.