| /dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/src/ |
| H A D | semi_empirical_store_int_types.F | 170 SUBROUTINE semi_empirical_si_initialize(store_int_env, geometry_did_change) argument
172 LOGICAL, INTENT(IN) :: geometry_did_change local
225 SUBROUTINE semi_empirical_si_finalize(store_int_env, geometry_did_change) argument
227 LOGICAL, INTENT(IN) :: geometry_did_change local
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| H A D | rtp_admm_methods.F | 208 mos, mos_aux_fit, rtp, rtp_coeff_aux_fit, geometry_did_change) argument
218 LOGICAL, INTENT(IN) :: geometry_did_change local
280 mos, mos_aux_fit, rtp, rtp_coeff_aux_fit, geometry_did_change) argument
289 LOGICAL, INTENT(IN) :: geometry_did_change local
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| H A D | hfx_ri.F | 756 geometry_did_change, nspins, hf_fraction) argument
764 LOGICAL, INTENT(IN) :: geometry_did_change local
912 homo, geometry_did_change, nspins) argument
918 LOGICAL, INTENT(IN) :: geometry_did_change local
1329 geometry_did_change, nspins) argument
1333 LOGICAL, INTENT(IN) :: geometry_did_change local
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| H A D | admm_methods.F | 529 mos, mos_aux_fit, geometry_did_change) argument
534 LOGICAL, INTENT(IN) :: geometry_did_change local
572 mos, geometry_did_change, blocked) argument
576 LOGICAL, INTENT(IN) :: geometry_did_change, blocked local
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| H A D | hfx_energy_potential.F | 135 geometry_did_change, irep, distribute_fock_matrix, & argument
145 LOGICAL :: geometry_did_change local
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| /dports/science/cp2k-data/cp2k-7.1.0/src/ |
| H A D | semi_empirical_store_int_types.F | 170 SUBROUTINE semi_empirical_si_initialize(store_int_env, geometry_did_change) argument
172 LOGICAL, INTENT(IN) :: geometry_did_change local
225 SUBROUTINE semi_empirical_si_finalize(store_int_env, geometry_did_change) argument
227 LOGICAL, INTENT(IN) :: geometry_did_change local
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| H A D | rtp_admm_methods.F | 200 mos, mos_aux_fit, rtp, rtp_coeff_aux_fit, geometry_did_change) argument
210 LOGICAL, INTENT(IN) :: geometry_did_change local
272 mos, mos_aux_fit, rtp, rtp_coeff_aux_fit, geometry_did_change) argument
281 LOGICAL, INTENT(IN) :: geometry_did_change local
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| H A D | admm_methods.F | 300 mos, mos_aux_fit, geometry_did_change) argument
305 LOGICAL, INTENT(IN) :: geometry_did_change local
343 mos, geometry_did_change, blocked) argument
347 LOGICAL, INTENT(IN) :: geometry_did_change, blocked local
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| H A D | hfx_energy_potential.F | 135 geometry_did_change, irep, distribute_fock_matrix, & argument
145 LOGICAL :: geometry_did_change local
|