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c88b37a9e6
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D2h excited states update
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2021-12-24 15:43:09 +01:00 |
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952a4b184a
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Manuscript update D2h excited states
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2021-12-23 18:39:12 +01:00 |
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ab6113fb09
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Autoisomerization part
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2021-12-14 13:50:37 +01:00 |
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c8e4d81ba2
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Manuscript updates
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2021-12-10 15:02:29 +01:00 |
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cf39ee9870
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modifs footnotes
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2021-11-29 15:28:23 +01:00 |
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2a6b18b889
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Notebook updates
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2021-11-29 15:01:04 +01:00 |
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c31007608a
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Manuscript
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2021-07-02 09:18:41 +02:00 |
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17318c887a
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Manuscript
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2021-06-10 11:10:19 +02:00 |
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bd8fa5b9af
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manuscript updates
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2021-05-17 15:06:15 +02:00 |
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b8cbbc42dd
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Merge branch 'master' of https://git.irsamc.ups-tlse.fr/loos/CBD
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2021-04-23 07:27:42 +02:00 |
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9cb7d3794e
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Manuscript + Notebook
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2021-04-23 07:27:35 +02:00 |
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bfbe43bedf
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results Martial
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2021-04-19 15:09:52 +02:00 |
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dbec5bf97b
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D4h Notebook and Manuscript updates
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2021-04-15 11:48:04 +02:00 |
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0a4512c20c
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outputs D4h SF-TDDFT
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2021-04-15 09:12:36 +02:00 |
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70fa327b71
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Merge branch 'master' of https://git.irsamc.ups-tlse.fr/loos/CBD
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2021-04-15 09:05:31 +02:00 |
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3ea3377b2f
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Merge branch 'master' of https://git.irsamc.ups-tlse.fr/loos/CBD
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2021-04-15 08:28:41 +02:00 |
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910292fa82
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D4h Table updates
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2021-04-15 08:28:24 +02:00 |
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2487
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a94f9faeb6
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remove slurm files
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2021-04-14 11:45:10 +02:00 |
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2487
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f93d5fcff4
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Merge branch 'master' of https://git.irsamc.ups-tlse.fr/loos/CBD
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2021-04-14 11:41:23 +02:00 |
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2487
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5ecada33f8
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CIPSI output files
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2021-04-14 11:41:05 +02:00 |
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1c54b466b4
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Tables D4h
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2021-04-14 11:38:59 +02:00 |
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5fa99d5dbb
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Table D2h
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2021-04-14 09:10:09 +02:00 |
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cbb0aea908
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Table CBD D2h
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2021-04-12 15:57:47 +02:00 |
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e90a525ea9
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CBD Manuscript
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2021-04-12 09:18:02 +02:00 |
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2c26e82e1a
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Manuscript
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2021-04-08 14:25:50 +02:00 |
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9ef6a28f01
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Manuscript
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2021-04-08 13:39:15 +02:00 |
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11afc0b397
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Merge branch 'master' of https://git.irsamc.ups-tlse.fr/loos/CBD
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2021-04-01 07:35:00 +02:00 |
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aafd7970a1
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CBD D4h outputs
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2021-04-01 07:34:22 +02:00 |
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b4ca26d952
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CBD Manuscript
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2021-04-01 07:33:54 +02:00 |
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6ccbd59794
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CBD Manuscript
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2021-03-31 11:55:38 +02:00 |
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f030e6a68f
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D4h outputs
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2021-03-31 07:18:11 +02:00 |
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f778e82ddb
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Merge branch 'master' of https://git.irsamc.ups-tlse.fr/loos/CBD
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2021-03-30 07:50:07 +02:00 |
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ec45f9ae64
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D4h outputs
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2021-03-30 07:49:22 +02:00 |
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9966ab65ab
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last value Toto
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2021-03-29 13:31:19 +02:00 |
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07afd688ac
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last value Toto
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2021-03-29 13:29:51 +02:00 |
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43c7fa3757
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Last data Denis
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2021-03-29 13:22:29 +02:00 |
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5ce348d995
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CBD D4h outputs
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2021-03-29 07:18:27 +02:00 |
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5f8fe6fa6a
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Merge branch 'master' of https://git.irsamc.ups-tlse.fr/loos/CBD
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2021-03-26 16:25:08 +01:00 |
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5e3a9f4574
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Manuscript
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2021-03-26 16:24:52 +01:00 |
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e5ce920e7b
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new data
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2021-03-26 15:48:45 +01:00 |
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1673e49464
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Merge branch 'master' of https://git.irsamc.ups-tlse.fr/loos/CBD
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2021-03-26 07:34:53 +01:00 |
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b2ca65806e
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D4h SF-ADC2-X AVTZ output
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2021-03-26 07:34:07 +01:00 |
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4123acdc9c
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Toto AVDZ
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2021-03-25 16:47:47 +01:00 |
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ea3f206e59
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authors
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2021-03-25 15:22:42 +01:00 |
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e78868d4bc
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authors
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2021-03-25 15:21:12 +01:00 |
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84792b94fb
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Manuscript CBD
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2021-03-25 15:09:46 +01:00 |
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7ccf36a492
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D4h SF-ADC2 AVTZ
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2021-03-25 07:26:12 +01:00 |
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9a0b38b3e1
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D4h outputs
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2021-03-23 15:00:29 +01:00 |
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2ad26002c1
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Merge branch 'master' of https://git.irsamc.ups-tlse.fr/loos/CBD
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2021-03-22 16:57:42 +01:00 |
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b4d0c86196
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SF-TDDFT D4h
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2021-03-22 16:57:11 +01:00 |
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