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all
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add scripts
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2022-01-28 22:56:12 +01:00 |
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Be2_cc-pvqz
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update PES
|
2021-11-03 18:08:46 +01:00 |
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Be2_cc-pvtz
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update
|
2022-02-20 21:59:09 +01:00 |
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benzene_cc-pvdz/GS_HF
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update
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2022-02-03 10:34:08 +01:00 |
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determinants
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update
|
2022-02-06 20:22:32 +01:00 |
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ethylene_cc-pvdz
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saving work
|
2022-02-24 19:32:25 +01:00 |
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excitation_energies
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update results
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2022-01-14 17:05:13 +01:00 |
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F2_cc-pvdz
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update
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2022-02-22 19:22:35 +01:00 |
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F2_cc-pvtz
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update
|
2022-02-01 20:49:03 +01:00 |
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H2O_cc-pvdz
|
update
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2022-02-18 09:55:37 +01:00 |
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H4_cc-pvdz
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update
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2022-02-18 18:24:42 +01:00 |
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H8_cc-pvdz
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saving work
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2022-02-25 19:48:45 +01:00 |
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HF_cc-pvdz
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saving work
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2022-02-25 19:48:45 +01:00 |
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HF_cc-pvtz
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saving work
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2022-02-25 19:51:36 +01:00 |
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LiH_cc-pvdz
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update
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2022-02-01 20:49:03 +01:00 |
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Manuscript
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saving work
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2022-02-25 19:51:36 +01:00 |
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N2_cc-pvdz
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update
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2022-02-22 19:22:35 +01:00 |
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Ne_cc-pvtz
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add scripts
|
2022-01-28 22:56:12 +01:00 |
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NPE
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update
|
2022-02-22 19:22:35 +01:00 |
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plot_all
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update plots
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2022-02-23 16:07:39 +01:00 |
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README.md
|
update PES
|
2021-11-03 18:08:46 +01:00 |
