Commit Graph

182 Commits

Author SHA1 Message Date
5b2d2f9799 cover letter 2022-04-11 16:00:37 +02:00
9e7d67903a rename for submission 2022-04-11 16:00:06 +02:00
47ae507ecd SI 2022-04-11 15:52:14 +02:00
4f70931fb5 OK with manuscript 2022-04-11 15:48:24 +02:00
4dade17fc7 ionic 2022-04-11 14:47:17 +02:00
efa71e0c35 AB figure 2022-04-11 13:40:30 +02:00
7258819f6f corrections martial 2022-04-11 13:33:38 +02:00
45e72c53f7 Toto typos 2022-04-11 10:07:03 +02:00
Pierre-Francois Loos
b2f4430d58 modifying discussion 2022-04-10 22:34:29 +02:00
b96aeaa01c updates CC4 and TBEs 2022-04-08 12:27:27 +02:00
d5b7c7e79e revise D4h TBE 2022-04-08 11:39:00 +02:00
01c53281c7 revise TBE for D4h 2022-04-08 11:22:22 +02:00
1f8ce097d4 Merge branch 'master' of git.irsamc.ups-tlse.fr:loos/CBD 2022-04-08 10:34:46 +02:00
c6c0cbcbbe revising D2h TBE 2022-04-08 10:34:38 +02:00
4f8b83f057 CCSD values in TBEs table 2022-04-08 10:07:41 +02:00
8f4e5df58d figure D2h with CCSD 2022-04-08 09:52:23 +02:00
9d94daaf04 CCSD D2h 2022-04-08 09:28:11 +02:00
Pierre-Francois Loos
b87280dada OK for Denis comments 2022-04-07 22:37:25 +02:00
Pierre-Francois Loos
13c66deeca Denis corrections 2022-04-07 21:34:35 +02:00
Pierre-Francois Loos
5288669637 donw for titou for now 2022-04-06 18:23:13 +02:00
Pierre-Francois Loos
68e1741294 saving work in final reading 2022-04-06 17:29:03 +02:00
Pierre-Francois Loos
1ae8c528ff rough first draft done 2022-04-06 14:26:14 +02:00
Pierre-Francois Loos
6b49657428 almost done with D4h 2022-04-06 12:21:30 +02:00
eb5d69eb59 Merge branch 'master' of https://git.irsamc.ups-tlse.fr/loos/CBD 2022-04-06 11:11:02 +02:00
4491dafb82 new figure2 2022-04-06 11:10:57 +02:00
Pierre-Francois Loos
6e8222d205 D4h SF-TDDFt 2022-04-06 11:08:41 +02:00
Pierre-Francois Loos
70478ff3a1 saving work in D4h 2022-04-05 22:22:40 +02:00
Pierre-Francois Loos
660adf0873 moving stuff in supporting information 2022-04-05 21:50:31 +02:00
5b83268c83 Merge branch 'master' of https://git.irsamc.ups-tlse.fr/loos/CBD 2022-04-05 16:28:24 +02:00
88c8a727bc Piotr reference values 2022-04-05 16:28:18 +02:00
82b80aec29 first cleanup of D2h done 2022-04-05 16:20:43 +02:00
cf15d753d0 fix bib 2022-04-05 15:33:24 +02:00
ffb9e30fc2 crash bib 2022-04-05 14:33:29 +02:00
25f571e1f4 resolving issue 2022-04-05 14:13:03 +02:00
af58b4346d saving work in D2h 2022-04-05 14:10:46 +02:00
ff3edf729d AB reference values 2022-04-05 14:06:01 +02:00
Pierre-Francois Loos
77fa7f4076 saving work in D2h 2022-04-04 22:17:48 +02:00
90770ba4b5 Merge branch 'master' of https://git.irsamc.ups-tlse.fr/loos/CBD 2022-04-04 16:55:08 +02:00
544d2845a7 updated figures+Ssquare 2022-04-04 16:54:09 +02:00
0875e53654 swap lines 2022-04-04 15:07:43 +02:00
a6d41f6490 SC-NEVPT2(12,12) figure 2 2022-04-04 10:01:47 +02:00
691ed04ccf SC and PC 2022-04-04 09:56:20 +02:00
6c31035f65 updated TBEs 2022-04-04 08:50:52 +02:00
a2f79e6e52 figures without MRCI 2022-04-04 08:42:24 +02:00
065a509078 figure 2 2022-04-04 08:39:34 +02:00
Pierre-Francois Loos
e34ac4f329 saving work in D2h 2022-04-02 21:30:39 +02:00
Pierre-Francois Loos
89a015658f new CAS results for (4,4) 2022-04-02 18:19:41 +02:00
Pierre-Francois Loos
3e4e572018 Merge branch 'master' of https://git.irsamc.ups-tlse.fr/loos/CBD 2022-04-01 10:32:23 +02:00
Pierre-Francois Loos
565a3840fc almost done with AB 2022-04-01 10:32:14 +02:00
24d2e83d51 Supporting 2022-04-01 10:23:41 +02:00