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7cb1e11daf
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Data for SI
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2021-07-31 21:49:09 +02:00 |
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0bb3ef2ed6
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getting reading for SI
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2021-07-31 21:46:20 +02:00 |
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73edaa36eb
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ready for submission
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2021-07-31 21:06:08 +02:00 |
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ca46b5e912
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saving work
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2021-07-31 15:09:42 +02:00 |
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e1762f8536
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Merge branch 'master' of git.irsamc.ups-tlse.fr:loos/Ec
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2021-07-31 03:41:05 +02:00 |
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a1ffc5f27e
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Tetrazine output
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2021-07-31 03:41:00 +02:00 |
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179eca38df
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Merge branch 'master' of git.irsamc.ups-tlse.fr:loos/Ec
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2021-07-31 03:40:26 +02:00 |
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d236bd67ab
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tetrazine
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2021-07-31 03:40:16 +02:00 |
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4bac2c76c6
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correction Denis
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2021-07-30 22:57:28 +02:00 |
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51c964415c
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remove JCP
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2021-07-30 14:15:05 +02:00 |
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5d84fc7a2b
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Merge branch 'master' of https://git.irsamc.ups-tlse.fr/loos/Ec
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2021-07-30 11:36:25 +02:00 |
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58e1f8c8dc
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correction Mika
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2021-07-30 11:36:20 +02:00 |
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7ef7e80094
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Outputs
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2021-07-30 11:29:51 +02:00 |
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966e02d4a6
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Merge branch 'master' of git.irsamc.ups-tlse.fr:loos/Ec
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2021-07-30 11:22:54 +02:00 |
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ced5dba91d
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Added tetrazine
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2021-07-30 11:22:20 +02:00 |
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9071a249fe
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10^-4
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2021-07-29 22:27:20 +02:00 |
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d247c3b329
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last data benzene et other
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2021-07-29 22:00:05 +02:00 |
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5b9b8ec489
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benzene+pyridine NO OK
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2021-07-29 19:22:54 +02:00 |
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1b716b14a6
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cover letter
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2021-07-28 22:00:53 +02:00 |
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ab71eb1a11
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cover letter
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2021-07-28 21:48:01 +02:00 |
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f8ce326afd
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ref update
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2021-07-28 21:47:37 +02:00 |
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b1f8117f51
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Correction Fabris again
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2021-07-28 21:33:56 +02:00 |
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beeb195dfe
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Merge branch 'master' of https://git.irsamc.ups-tlse.fr/loos/Ec
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2021-07-28 21:29:50 +02:00 |
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7e56702886
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Fabris corrections
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2021-07-28 21:29:43 +02:00 |
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kossoski
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79fb0fdafa
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macroiteration
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2021-07-28 14:10:26 +02:00 |
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kossoski
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4c01ba3e6a
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corrections Secs. IV and V
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2021-07-28 13:48:05 +02:00 |
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kossoski
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3493690217
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corrections Secs. II and III
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2021-07-28 12:44:06 +02:00 |
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kossoski
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d8a7c6552f
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corrections Sec. I
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2021-07-28 12:08:49 +02:00 |
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6e004d4677
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mimi comments
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2021-07-28 11:01:08 +02:00 |
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e2b4381370
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minor corrections b4 sending it to coauthors
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2021-07-27 14:26:03 +02:00 |
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21e45f7366
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adding CR-CC results and references
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2021-07-26 18:15:07 +02:00 |
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3c4a27459d
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CR-CC23
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2021-07-26 18:01:20 +02:00 |
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75bb0f8dc2
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Merge branch 'master' of https://git.irsamc.ups-tlse.fr/loos/Ec
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2021-07-26 17:08:50 +02:00 |
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93d6490aac
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save b4 pull
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2021-07-26 17:08:45 +02:00 |
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7234f9ff03
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Added GAMESS files
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2021-07-26 17:07:27 +02:00 |
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a106049201
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Added refs for Gamess
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2021-07-26 15:14:15 +02:00 |
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4e9035d08c
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Added GAMESS CC results
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2021-07-26 15:02:40 +02:00 |
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b026cbdea7
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Merge branch 'master' of git.irsamc.ups-tlse.fr:loos/Ec
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2021-07-26 11:39:43 +02:00 |
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2fe13afd6f
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Modifs Toto
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2021-07-26 11:39:37 +02:00 |
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f08592a6d1
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conclusion
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2021-07-26 11:14:01 +02:00 |
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67b47d9987
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OK up to conclusion
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2021-07-25 22:29:36 +02:00 |
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5a713742d6
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OK up to res
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2021-07-25 22:17:00 +02:00 |
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f028a860db
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moving down computational details
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2021-07-25 22:02:35 +02:00 |
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d5bb4a2a4e
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acknowledgement and cpu hours
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2021-07-25 21:05:24 +02:00 |
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db36e70094
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OK with results
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2021-07-23 18:25:16 +02:00 |
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b57c6eedc6
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saving work in 2nd part of results
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2021-07-23 16:24:13 +02:00 |
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26cc3293fa
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saving work in benchmark section
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2021-07-23 12:14:07 +02:00 |
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eeec28a26c
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small modifications in III
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2021-07-21 15:59:33 +02:00 |
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d5b2568371
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Typos
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2021-07-21 11:44:35 +02:00 |
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11c9c7bb71
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saving work b4 2nd pfizer jab
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2021-07-21 11:13:24 +02:00 |
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