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1st draft of Sec III
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2021-07-20 14:26:18 +02:00 |
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saving work
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saving work
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saving work in theory section
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saving work before OO section
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2021-07-07 10:25:00 +02:00 |
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2021-07-06 14:26:27 +02:00 |
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Merge branch 'master' of git.irsamc.ups-tlse.fr:loos/Ec
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2021-07-05 10:57:32 +02:00 |
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c75227b365
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Update pyrazine
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2021-07-05 10:57:25 +02:00 |
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saving work
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2021-07-02 07:18:33 +02:00 |
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working on equations
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2021-07-01 22:58:59 +02:00 |
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updated data
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2021-07-01 09:08:52 +02:00 |
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Merge branch 'master' of git.irsamc.ups-tlse.fr:loos/Ec
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2021-06-29 13:36:28 +02:00 |
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2021-06-29 13:36:24 +02:00 |
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update
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2021-06-29 13:29:56 +02:00 |
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module
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2021-06-29 13:15:31 +02:00 |
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update
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2021-06-27 23:02:23 +02:00 |
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25dbfafcd3
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Added data files
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2021-06-27 22:55:47 +02:00 |
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2e34149864
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Added optimized MOs
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2021-06-21 14:43:56 +02:00 |
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Added MOs
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2021-06-21 14:08:00 +02:00 |
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Added geometries
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2021-06-21 14:02:06 +02:00 |
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2021-06-21 14:01:29 +02:00 |
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saving work in CIPSI section
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saving work in manuscript
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saving work in manuscript
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saving work in intro
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savinf work in intro
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clean up data
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2021-01-22 22:24:58 +01:00 |
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update notebook
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2021-01-22 21:55:15 +01:00 |
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data files
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Merge branch 'master' of git.irsamc.ups-tlse.fr:loos/Ec
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2021-01-18 10:31:46 +01:00 |
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Update outputs
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Merge branch 'master' of https://git.irsamc.ups-tlse.fr/loos/Ec
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2021-01-02 15:32:38 +01:00 |
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furan/6-31g
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6-31g furan
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2021-01-02 15:30:56 +01:00 |
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Restart imidazole 10 nodes
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2020-12-26 14:39:46 +01:00 |
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Update outputs
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2020-12-24 15:33:57 +01:00 |
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Restart triazine
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Restart pyridine
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2020-12-17 13:46:40 +01:00 |
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2020-12-17 09:21:54 +01:00 |
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Merge branch 'master' of git.irsamc.ups-tlse.fr:loos/Ec
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2020-12-15 10:10:40 +01:00 |
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Restart localized pyridazine
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2020-12-15 10:09:56 +01:00 |
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2020-12-15 10:03:39 +01:00 |
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2020-12-12 09:13:54 +01:00 |
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update benzene furan
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2020-12-12 09:13:25 +01:00 |
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