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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
|
saving work
|
2021-01-17 09:58:57 +01:00 |
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cb8bbbcf55
|
fci outputs
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2021-01-16 20:18:04 +01:00 |
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ae42fa3f92
|
saving work in Be
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2021-01-16 14:25:33 +01:00 |
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a48eed1393
|
saving work in Be
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2021-01-16 13:48:36 +01:00 |
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1db56f7dd2
|
Be big basis
|
2021-01-15 22:59:16 +01:00 |
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230de50013
|
cbutadiene results q-chem
|
2021-01-15 11:21:40 +01:00 |
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7eca342a8a
|
rearrangement
|
2021-01-15 11:15:57 +01:00 |
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3f84c3cc51
|
cbutadiene results
|
2021-01-15 11:10:58 +01:00 |
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40166bb38c
|
Be results
|
2021-01-15 11:04:59 +01:00 |
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19fd545614
|
Be results
|
2021-01-15 11:03:18 +01:00 |
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92c2724190
|
Figure BSE + Tables
|
2021-01-15 11:01:01 +01:00 |
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05bedeaa18
|
CBD graphs
|
2021-01-14 22:29:44 +01:00 |
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d8fc754bb4
|
manuscript
|
2021-01-14 17:45:19 +01:00 |
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fe803e953e
|
figures
|
2021-01-14 17:33:30 +01:00 |
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962267e5df
|
figures and Manuscript
|
2021-01-14 17:32:26 +01:00 |
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f58e21bfca
|
bla bla bla
|
2021-01-14 15:15:01 +01:00 |
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9479802861
|
Merge branch 'master' of https://git.irsamc.ups-tlse.fr/loos/sfBSE
|
2021-01-14 15:12:46 +01:00 |
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4ecf3f7cff
|
blablabla
|
2021-01-14 15:12:27 +01:00 |
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b15921d615
|
bla bla bla
|
2021-01-14 15:11:30 +01:00 |
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e13c8c5766
|
Manuscript
|
2021-01-14 10:48:03 +01:00 |
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da082e6784
|
figures
|
2021-01-14 08:22:43 +01:00 |
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89e4709884
|
Manuscript
|
2021-01-13 12:07:01 +01:00 |
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9257c70b8e
|
modifs again
|
2021-01-13 10:15:19 +01:00 |
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4048b358af
|
Manuscript
|
2021-01-13 09:57:10 +01:00 |
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c7d03c369a
|
modifications in computational details
|
2021-01-13 09:43:24 +01:00 |
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aed52338dd
|
Figures for H2
|
2021-01-12 21:35:31 +01:00 |
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9c63827e21
|
Manuscript
|
2021-01-12 11:48:36 +01:00 |
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122bcbae58
|
Notebook + Manuscript
|
2021-01-12 10:06:42 +01:00 |
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|
00cf2ba88b
|
Notebook + Manuscript
|
2021-01-12 10:02:57 +01:00 |
|
|
|
ec35e13a16
|
minor changes
|
2021-01-11 10:46:21 +01:00 |
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1c9454fd45
|
saving work before meeting
|
2021-01-11 09:52:33 +01:00 |
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058d9d7fae
|
Merge branch 'master' of https://git.irsamc.ups-tlse.fr/loos/sfBSE
|
2021-01-11 09:45:27 +01:00 |
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74bc1fa443
|
saving work before meeting
|
2021-01-11 09:45:19 +01:00 |
|
