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obj
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major modification for makefiles
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2020-09-30 00:10:57 +02:00 |
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core_guess.f90
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level shift and proper guess
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2022-02-02 15:06:51 +01:00 |
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density_matrix.f90
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remove COHSEX and modify phLR in GW routines
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2023-07-18 14:59:18 +02:00 |
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density.f90
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remove COHSEX and modify phLR in GW routines
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2023-07-18 14:59:18 +02:00 |
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dipole_moment.f90
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remove COHSEX and modify phLR in GW routines
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2023-07-18 14:59:18 +02:00 |
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GHF_search.f90
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plenty of CC for GHF reference
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2023-11-13 22:15:00 +01:00 |
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GHF_stability.f90
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fix bug in GHF search
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2023-11-07 16:11:01 +01:00 |
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GHF.f90
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trying to fix collinearity test
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2023-11-15 00:52:12 +01:00 |
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huckel_guess.f90
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level shift and proper guess
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2022-02-02 15:06:51 +01:00 |
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Makefile
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bug in makefile debug
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2020-10-14 16:02:09 +02:00 |
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mix_guess.f90
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restructuration QuAcK for restricted and unrestricted branches
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2023-10-25 21:38:20 +02:00 |
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mo_guess.f90
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HF solution search
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2023-11-03 19:48:12 +01:00 |
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MOM_overlap.f90
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remove COHSEX and modify phLR in GW routines
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2023-07-18 14:59:18 +02:00 |
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print_GHF.f90
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Merge branch 'abd' into master
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2023-11-16 15:52:06 +01:00 |
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print_RHF.f90
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fix ROHF
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2023-11-09 23:23:00 +01:00 |
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print_ROHF.f90
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S components for UHF
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2023-11-15 21:58:32 +01:00 |
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print_UHF.f90
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S components for UHF
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2023-11-15 21:58:32 +01:00 |
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RHF_search.f90
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plenty of CC for GHF reference
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2023-11-13 22:15:00 +01:00 |
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RHF_stability.f90
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fix bug in GHF search
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2023-11-07 16:11:01 +01:00 |
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RHF.f90
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modify print in test
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2023-11-14 14:31:27 +01:00 |
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RMOM.f90
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working on GHF
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2023-10-26 09:35:48 +02:00 |
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ROHF_fock_matrix.f90
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rename AOtoMO and MOtoAO
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2023-11-10 17:22:51 +01:00 |
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ROHF.f90
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introduce test in MP and RPA
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2023-11-11 23:00:00 +01:00 |
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UHF_search.f90
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plenty of CC for GHF reference
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2023-11-13 22:15:00 +01:00 |
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UHF_stability.f90
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fix bug in GHF search
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2023-11-07 16:11:01 +01:00 |
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UHF.f90
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add more test in HF
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2023-11-12 23:02:20 +01:00 |
