Searched refs:A_ia_rspace_sub (Results 1 – 3 of 3) sorted by relevance
/dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/src/ |
H A D | qs_tddfpt2_fhxc.F | 147 CALL pw_zero(work_matrices%A_ia_rspace_sub(ispin)%pw) 152 CALL tddfpt_apply_xc(A_ia_rspace=work_matrices%A_ia_rspace_sub, kernel_env=kernel_env, & 167 CALL tddfpt_apply_xc(A_ia_rspace=work_matrices%A_ia_rspace_sub, & 183 CALL tddfpt_apply_coulomb(A_ia_rspace=work_matrices%A_ia_rspace_sub, & 191 CALL pw_scale(work_matrices%A_ia_rspace_sub(ispin)%pw, & 192 work_matrices%A_ia_rspace_sub(ispin)%pw%pw_grid%dvol) 194 CALL integrate_v_rspace(v_rspace=work_matrices%A_ia_rspace_sub(ispin), &
|
H A D | qs_tddfpt2_types.F | 168 TYPE(pw_p_type), DIMENSION(:), POINTER :: A_ia_rspace_sub component 418 ALLOCATE (work_matrices%A_ia_rspace_sub(nspins)) 421 NULLIFY (work_matrices%A_ia_rspace_sub(ispin)%pw) 422 CALL pw_pool_create_pw(auxbas_pw_pool, work_matrices%A_ia_rspace_sub(ispin)%pw, & 583 NULLIFY (work_matrices%A_ia_rspace_sub, work_matrices%wpw_gspace_sub, & 637 CALL pw_pool_give_back_pw(auxbas_pw_pool, work_matrices%A_ia_rspace_sub(ispin)%pw) 639 …DEALLOCATE (work_matrices%A_ia_rspace_sub, work_matrices%wpw_gspace_sub, work_matrices%wpw_rspace_…
|
/dports/science/cp2k-data/cp2k-7.1.0/src/ |
H A D | qs_tddfpt2_methods.F | 248 TYPE(pw_p_type), DIMENSION(:), POINTER :: A_ia_rspace_sub component 823 ALLOCATE (work_matrices%A_ia_rspace_sub(nspins)) 826 NULLIFY (work_matrices%A_ia_rspace_sub(ispin)%pw) 827 CALL pw_pool_create_pw(auxbas_pw_pool, work_matrices%A_ia_rspace_sub(ispin)%pw, & 912 CALL pw_pool_give_back_pw(auxbas_pw_pool, work_matrices%A_ia_rspace_sub(ispin)%pw) 2318 CALL pw_zero(work_matrices%A_ia_rspace_sub(ispin)%pw) 2323 CALL tddfpt_apply_xc(A_ia_rspace=work_matrices%A_ia_rspace_sub, kernel_env=kernel_env, & 2338 CALL tddfpt_apply_xc(A_ia_rspace=work_matrices%A_ia_rspace_sub, & 2354 CALL tddfpt_apply_coulomb(A_ia_rspace=work_matrices%A_ia_rspace_sub, & 2362 …CALL pw_scale(work_matrices%A_ia_rspace_sub(ispin)%pw, work_matrices%A_ia_rspace_sub(ispin)%pw%pw_… [all …]
|