| /dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/src/ |
| H A D | mp2_eri_gpw.F | 101 … pw_env_sub, external_vector, poisson_env, rho_r, pot_g, ri_metric, omega_metric, mat_munu, & argument
114 TYPE(pw_p_type), INTENT(INOUT) :: rho_r, pot_g local
198 TYPE(pw_p_type) :: pot_g, psi_L, rho_g, rho_r local
380 … auxbas_pw_pool, poisson_env, task_list_sub, rho_r, rho_g, pot_g, psi_L, sab_orb_sub) argument
391 TYPE(pw_p_type), INTENT(OUT) :: rho_r, rho_g, pot_g, psi_L local
479 task_list_sub, auxbas_pw_pool, rho_r, rho_g, pot_g, psi_L) argument
487 TYPE(pw_p_type), INTENT(INOUT) :: rho_r, rho_g, pot_g, psi_L local
525 SUBROUTINE calc_potential_gpw(rho_r, rho_g, poisson_env, pot_g, potential_type, omega) argument
528 TYPE(pw_p_type), INTENT(IN) :: pot_g local
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| H A D | mp2_cphf.F | 173 TYPE(pw_p_type) :: dvg(3), pot_g, rho_g, rho_r, temp_pw_g local
932 rho_work, pot_g, rho_g, rho_r, mat_mu_nu, P_mu_nu, & argument
946 TYPE(pw_p_type) :: pot_g, rho_g, rho_r local
1348 rho_work, pot_g, rho_g, rho_r, mat_mu_nu, P_mu_nu, & argument
1363 TYPE(pw_p_type) :: pot_g, rho_g, rho_r local
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| H A D | fist_force.F | 83 REAL(KIND=dp) :: pot_nonbond, pot_g, pot_bond component
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| H A D | hfx_admm_utils.F | 632 TYPE(pw_p_type) :: pot_g, rho_g, rho_r local
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| H A D | mp2_gpw_method.F | 172 TYPE(pw_p_type) :: pot_g, psi_a, rho_g, rho_r local
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| H A D | mp2_ri_grad.F | 198 … TYPE(pw_p_type) :: dvg(3), pot_g, psi_L, psi_L_beta, rho_g, & local
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| H A D | qs_active_space_methods.F | 961 TYPE(pw_p_type) :: pot_g, rho_g, rho_r, wfn_r local
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| H A D | mp2_integrals.F | 279 TYPE(pw_p_type) :: pot_g, psi_L, rho_g, rho_r local
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| /dports/science/cp2k-data/cp2k-7.1.0/src/ |
| H A D | mp2_eri_gpw.F | 100 … pw_env_sub, external_vector, poisson_env, rho_r, pot_g, ri_metric, omega_metric, mat_munu, & argument
113 TYPE(pw_p_type), INTENT(INOUT) :: rho_r, pot_g local
197 TYPE(pw_p_type) :: pot_g, psi_L, rho_g, rho_r local
377 … auxbas_pw_pool, poisson_env, task_list_sub, rho_r, rho_g, pot_g, psi_L, sab_orb_sub) argument
388 TYPE(pw_p_type), INTENT(OUT) :: rho_r, rho_g, pot_g, psi_L local
476 task_list_sub, auxbas_pw_pool, rho_r, rho_g, pot_g, psi_L) argument
484 TYPE(pw_p_type), INTENT(INOUT) :: rho_r, rho_g, pot_g, psi_L local
522 SUBROUTINE calc_potential_gpw(rho_r, rho_g, poisson_env, pot_g, potential_type, omega) argument
525 TYPE(pw_p_type), INTENT(IN) :: pot_g local
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| H A D | mp2_cphf.F | 173 TYPE(pw_p_type) :: dvg(3), pot_g, rho_g, rho_r, temp_pw_g local
932 rho_work, pot_g, rho_g, rho_r, mat_mu_nu, P_mu_nu, & argument
946 TYPE(pw_p_type) :: pot_g, rho_g, rho_r local
1348 rho_work, pot_g, rho_g, rho_r, mat_mu_nu, P_mu_nu, & argument
1363 TYPE(pw_p_type) :: pot_g, rho_g, rho_r local
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| H A D | fist_force.F | 83 REAL(KIND=dp) :: pot_nonbond, pot_g, pot_bond component
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| H A D | hfx_admm_utils.F | 456 TYPE(pw_p_type) :: pot_g, rho_g, rho_r local
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| H A D | mp2_gpw_method.F | 172 TYPE(pw_p_type) :: pot_g, psi_a, rho_g, rho_r local
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| H A D | mp2_ri_grad.F | 197 … TYPE(pw_p_type) :: dvg(3), pot_g, psi_L, psi_L_beta, rho_g, & local
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| H A D | qs_active_space_methods.F | 961 TYPE(pw_p_type) :: pot_g, rho_g, rho_r, wfn_r local
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| H A D | mp2_integrals.F | 312 TYPE(pw_p_type) :: pot_g, psi_L, rho_g, rho_r local
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