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3c1cc67254
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Merge branch 'master' of https://git.irsamc.ups-tlse.fr/loos/sfBSE
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2021-01-19 15:21:44 +01:00 |
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08bcfe005d
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typo
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2021-01-19 15:21:30 +01:00 |
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a9c5953927
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remove tddft qchem results
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2021-01-19 14:37:10 +01:00 |
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5f2b87cd35
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H2 CIS results
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2021-01-19 14:32:36 +01:00 |
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5ffb54703c
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H2 CIS output
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2021-01-19 14:22:38 +01:00 |
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9ab1eb9ab0
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Merge branch 'master' of https://git.irsamc.ups-tlse.fr/loos/sfBSE
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2021-01-19 14:11:38 +01:00 |
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b90703cad1
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H2 output
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2021-01-19 14:09:55 +01:00 |
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bcbc2d53f4
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paragraph for S2 in H2
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2021-01-19 14:03:31 +01:00 |
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0e294ec542
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Done with computational details
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2021-01-19 12:28:16 +01:00 |
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7379c6db23
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conclusion
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2021-01-19 12:20:28 +01:00 |
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c26e52bf23
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S2 figures
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2021-01-19 11:52:37 +01:00 |
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326c8058b0
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S2 figures
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2021-01-19 11:48:58 +01:00 |
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1c31cca939
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done with BSE
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2021-01-19 10:05:09 +01:00 |
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39168c9395
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done with GW section
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2021-01-19 09:52:21 +01:00 |
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fefe95a0a9
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done with abstract and introduction
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2021-01-19 09:37:36 +01:00 |
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573e9047f1
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Done with results for now
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2021-01-18 21:27:59 +01:00 |
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cd85cf4d3c
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Done with CBD for now
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2021-01-18 18:23:34 +01:00 |
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5c8d045d51
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almost done with CBD
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2021-01-18 17:09:57 +01:00 |
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d6dad8419b
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done with H2 for now
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2021-01-18 15:40:29 +01:00 |
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1267eac57c
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new figures
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2021-01-18 13:59:36 +01:00 |
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375b013c8b
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fix conflict
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2021-01-18 11:50:38 +01:00 |
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6873d4a413
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Table Be
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2021-01-18 11:46:03 +01:00 |
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241030dd19
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done for now with Be results
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2021-01-18 11:45:10 +01:00 |
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9b176ba9ef
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done for now with Be results
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2021-01-18 11:35:53 +01:00 |
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4aef613a8e
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last SF-CIS numbers
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2021-01-18 10:05:45 +01:00 |
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756775fa2a
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test
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2021-01-18 09:38:41 +01:00 |
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79ebaaf3aa
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BSE output H2
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2021-01-18 09:35:59 +01:00 |
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4db0bb356b
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grid
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2021-01-17 23:27:46 +01:00 |
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bcd765e332
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saving work in results
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2021-01-17 22:45:54 +01:00 |
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2632bf1fae
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new figures from Enzo
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2021-01-17 21:28:19 +01:00 |
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e2e6567947
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oscillator strenght
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2021-01-17 21:23:36 +01:00 |
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71254a83b4
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cleanup bib
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2021-01-17 20:18:37 +01:00 |
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ae9674c03f
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saving work in H2
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2021-01-17 15:25:29 +01:00 |
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1912a3875f
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saving work in H2
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2021-01-17 15:11:21 +01:00 |
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7a3d60c3f4
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saving work
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2021-01-17 10:06:31 +01:00 |
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e7c1acf66a
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saving work
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2021-01-17 09:58:57 +01:00 |
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cb8bbbcf55
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fci outputs
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2021-01-16 20:18:04 +01:00 |
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ae42fa3f92
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saving work in Be
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2021-01-16 14:25:33 +01:00 |
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a48eed1393
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saving work in Be
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2021-01-16 13:48:36 +01:00 |
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1db56f7dd2
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Be big basis
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2021-01-15 22:59:16 +01:00 |
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230de50013
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cbutadiene results q-chem
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2021-01-15 11:21:40 +01:00 |
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7eca342a8a
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rearrangement
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2021-01-15 11:15:57 +01:00 |
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3f84c3cc51
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cbutadiene results
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2021-01-15 11:10:58 +01:00 |
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40166bb38c
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Be results
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2021-01-15 11:04:59 +01:00 |
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19fd545614
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Be results
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2021-01-15 11:03:18 +01:00 |
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92c2724190
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Figure BSE + Tables
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2021-01-15 11:01:01 +01:00 |
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05bedeaa18
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CBD graphs
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2021-01-14 22:29:44 +01:00 |
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d8fc754bb4
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manuscript
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2021-01-14 17:45:19 +01:00 |
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fe803e953e
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figures
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2021-01-14 17:33:30 +01:00 |
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962267e5df
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figures and Manuscript
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2021-01-14 17:32:26 +01:00 |
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