| /dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/src/ |
| H A D | mp2_eri_gpw.F | 102 qs_env, task_list_sub) argument
119 TYPE(task_list_type), POINTER :: task_list_sub local
205 TYPE(task_list_type), POINTER :: task_list_sub local
355 task_list_sub, auxbas_pw_pool, rho_r, rho_g, pot_g, psi_L)
390 TYPE(task_list_type), POINTER :: task_list_sub local
433 NULLIFY (task_list_sub)
435 CALL allocate_task_list(task_list_sub)
436 CALL generate_qs_task_list(ks_env, task_list_sub, &
479 task_list_sub, auxbas_pw_pool, rho_r, rho_g, pot_g, psi_L) argument
485 TYPE(task_list_type), POINTER :: task_list_sub local
[all …]
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| H A D | mp2_gpw_method.F | 176 TYPE(task_list_type), POINTER :: task_list_sub local
246 … auxbas_pw_pool, poisson_env, task_list_sub, rho_r, rho_g, pot_g, psi_a, sab_orb_sub)
456 pw_env_external=pw_env_sub, task_list_external=task_list_sub)
612 task_list_sub, auxbas_pw_pool, rho_r, rho_g, pot_g, psi_a)
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| H A D | qs_active_space_methods.F | 968 TYPE(task_list_type), POINTER :: task_list_sub local
1042 NULLIFY (task_list_sub)
1045 CALL allocate_task_list(task_list_sub)
1046 CALL generate_qs_task_list(ks_env, task_list_sub, &
1206 CALL deallocate_task_list(task_list_sub)
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| H A D | mp2_integrals.F | 282 TYPE(task_list_type), POINTER :: task_list_sub local
675 … auxbas_pw_pool, poisson_env, task_list_sub, rho_r, rho_g, pot_g, psi_L, sab_orb_sub)
681 … ri_metric%potential_type, ri_metric%omega, mat_munu, qs_env, task_list_sub)
716 task_list_sub, auxbas_pw_pool, rho_r, rho_g, pot_g, psi_L)
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| H A D | mp2_ri_grad.F | 207 TYPE(task_list_type), POINTER :: task_list_sub local
392 … auxbas_pw_pool, poisson_env, task_list_sub, rho_r, rho_g, pot_g, psi_L, sab_orb_sub)
633 task_list_external=task_list_sub)
690 task_list_external=task_list_sub, &
892 task_list_sub, auxbas_pw_pool, rho_r, rho_g, pot_g, psi_L)
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| /dports/science/cp2k-data/cp2k-7.1.0/src/ |
| H A D | mp2_eri_gpw.F | 101 qs_env, task_list_sub) argument
118 TYPE(task_list_type), POINTER :: task_list_sub local
204 TYPE(task_list_type), POINTER :: task_list_sub local
352 task_list_sub, auxbas_pw_pool, rho_r, rho_g, pot_g, psi_L)
387 TYPE(task_list_type), POINTER :: task_list_sub local
430 NULLIFY (task_list_sub)
432 CALL allocate_task_list(task_list_sub)
433 CALL generate_qs_task_list(ks_env, task_list_sub, &
476 task_list_sub, auxbas_pw_pool, rho_r, rho_g, pot_g, psi_L) argument
482 TYPE(task_list_type), POINTER :: task_list_sub local
[all …]
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| H A D | mp2_gpw_method.F | 176 TYPE(task_list_type), POINTER :: task_list_sub local
246 … auxbas_pw_pool, poisson_env, task_list_sub, rho_r, rho_g, pot_g, psi_a, sab_orb_sub)
456 pw_env_external=pw_env_sub, task_list_external=task_list_sub)
612 task_list_sub, auxbas_pw_pool, rho_r, rho_g, pot_g, psi_a)
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| H A D | qs_active_space_methods.F | 968 TYPE(task_list_type), POINTER :: task_list_sub local
1042 NULLIFY (task_list_sub)
1045 CALL allocate_task_list(task_list_sub)
1046 CALL generate_qs_task_list(ks_env, task_list_sub, &
1206 CALL deallocate_task_list(task_list_sub)
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| H A D | mp2_ri_grad.F | 206 TYPE(task_list_type), POINTER :: task_list_sub local
391 … auxbas_pw_pool, poisson_env, task_list_sub, rho_r, rho_g, pot_g, psi_L, sab_orb_sub)
629 task_list_external=task_list_sub)
686 task_list_external=task_list_sub, &
885 task_list_sub, auxbas_pw_pool, rho_r, rho_g, pot_g, psi_L)
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| H A D | mp2_integrals.F | 315 TYPE(task_list_type), POINTER :: task_list_sub local
678 … auxbas_pw_pool, poisson_env, task_list_sub, rho_r, rho_g, pot_g, psi_L, sab_orb_sub)
684 … ri_metric%potential_type, ri_metric%omega, mat_munu, qs_env, task_list_sub)
719 task_list_sub, auxbas_pw_pool, rho_r, rho_g, pot_g, psi_L)
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