Searched refs:rho_output (Results 1 – 4 of 4) sorted by relevance
/dports/science/cp2k-data/cp2k-7.1.0/src/ |
H A D | qs_rho_methods.F | 585 CPASSERT(ASSOCIATED(rho_output)) 593 CALL qs_rho_clear(rho_output) 618 CALL qs_rho_set(rho_output, rho_ao=rho_ao_out) 630 CALL qs_rho_set(rho_output, rho_r=rho_r_out) 641 CALL qs_rho_set(rho_output, rho_g=rho_g_out) 664 CALL qs_rho_set(rho_output, drho_r=drho_r_out) 675 CALL qs_rho_set(rho_output, drho_g=drho_g_out) 692 CALL qs_rho_set(rho_output, tau_r=tau_r_out) 703 CALL qs_rho_set(rho_output, tau_g=tau_g_out) 713 CALL qs_rho_set(rho_output, & [all …]
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H A D | qs_scf_initialization.F | 1056 … rho_output=qs_env%wf_history%past_states(1)%snapshot%rho_frozen, &
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/dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/src/ |
H A D | qs_rho_methods.F | 598 CPASSERT(ASSOCIATED(rho_output)) 606 CALL qs_rho_clear(rho_output) 631 CALL qs_rho_set(rho_output, rho_ao=rho_ao_out) 643 CALL qs_rho_set(rho_output, rho_r=rho_r_out) 654 CALL qs_rho_set(rho_output, rho_g=rho_g_out) 677 CALL qs_rho_set(rho_output, drho_r=drho_r_out) 688 CALL qs_rho_set(rho_output, drho_g=drho_g_out) 705 CALL qs_rho_set(rho_output, tau_r=tau_r_out) 716 CALL qs_rho_set(rho_output, tau_g=tau_g_out) 726 CALL qs_rho_set(rho_output, & [all …]
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H A D | qs_scf_initialization.F | 1080 … rho_output=qs_env%wf_history%past_states(1)%snapshot%rho_frozen, &
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