compilation
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Fixed singles when no beta exc
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2023-06-10 11:56:07 +02:00 |
ezfio_interface
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allow no basis set
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2023-05-10 15:05:18 +02:00 |
functionals/do_not_touch_func
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Develop (#10)
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2019-02-22 19:19:58 +01:00 |
module
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Fixing directories without NEED
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2023-02-06 11:46:04 +01:00 |
utility
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Improve 5idx
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2023-06-02 20:32:31 +02:00 |
verif_omp
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OpenMP nested merged
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2021-11-29 10:39:34 +01:00 |
.gitignore
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gitignore in include
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2023-02-06 17:57:07 +01:00 |
cipsi_save.sh
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Add cipsi_save.sh
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2022-04-11 23:55:17 +02:00 |
get_fci_conv.sh
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added the get_fci_conv.sh script
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2023-03-16 22:11:26 +01:00 |
get_fci_tc_conv.sh
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added Hn.py
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2023-03-28 12:43:15 +02:00 |
hello.py
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First python3 3 working installation
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2020-03-17 18:02:29 +01:00 |
Hn.py
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added Hn.py
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2023-03-28 12:43:15 +02:00 |
perturbation.py
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First python3 3 working installation
|
2020-03-17 18:02:29 +01:00 |
qp_exc_energy.py
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Added qp_json
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2023-05-10 11:14:57 +02:00 |
qp_import_trexio.py
|
Improve 5idx
|
2023-06-02 20:32:31 +02:00 |
remove_trailing_spaces
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Initial commit
|
2019-01-25 11:39:31 +01:00 |
save_current_mos.sh
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Initial commit
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2019-01-25 11:39:31 +01:00 |
script_fci_tc.sh
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added script_fci_tc.sh
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2023-03-17 11:26:51 +01:00 |