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mirror of https://github.com/pfloos/quack synced 2024-12-22 12:23:50 +01:00
Commit Graph

1259 Commits

Author SHA1 Message Date
Abdallah Ammar
89d7394e48 Update .gitmodules and remove utils/lapack-release submodule entry 2024-11-15 10:30:02 +01:00
Abdallah Ammar
9986ff09dd q -> p in RGW_self_energy 2024-11-05 07:56:10 +01:00
Abdallah Ammar
52a1346bdb q -> p in GGW_self_energy 2024-11-05 07:48:49 +01:00
d1f9daa3e5 remove warning in ufG0T0pp 2024-11-04 19:35:42 +01:00
4692017d56 remove warnings 2024-11-04 19:30:06 +01:00
Abdallah Ammar
336c67ac3c rm more warnings in Davidson 2024-11-04 19:09:00 +01:00
Antoine Marie
9090133281 Merge branch 'master' of github.com:pfloos/QuAcK 2024-11-04 17:01:09 +01:00
Antoine Marie
0554bdd53f full ppBSE@GT and full dynBSE@GW in spin orbital and spatial orb 2024-11-04 17:00:51 +01:00
Abdallah Ammar
fcb9c16313 dav warnings 2024-11-04 15:15:49 +01:00
Abdallah Ammar
bb0d68eef0 fixed conflic bef merging 2024-11-04 11:31:36 +01:00
Abdallah Ammar
b0eb4cb55e saving work on Dav on Olympe 2024-11-04 11:29:41 +01:00
33a2debb3a Merge branch 'master' of github.com:pfloos/QuAcK 2024-10-31 19:36:15 +01:00
2500a98feb one micro modif in RGW_phBSE 2024-10-31 19:36:08 +01:00
Antoine Marie
6ed7fd09be saving work in T matrix kernel 2024-10-31 17:17:50 +01:00
Antoine Marie
21e5b55641 Merge branch 'master' of github.com:pfloos/QuAcK 2024-10-31 16:07:52 +01:00
Antoine Marie
5b5d3376c9 T matrix kernel of the ppBSE working in TDA in RHF and GHF 2024-10-31 16:07:25 +01:00
Pierre-Francois Loos
6667fb79c1 debuging UACFDT 2024-10-31 12:15:01 +01:00
127aeabf72 more cleaning 2024-10-30 10:44:39 +01:00
1a4ad3e225 cleaning 2024-10-30 10:08:39 +01:00
Antoine Marie
df7f38b7b5 ppBSE GT 2024-10-30 09:41:25 +01:00
Antoine Marie
1ca40c25c4 Merge branch 'master' of github.com:pfloos/QuAcK 2024-10-30 09:37:06 +01:00
Antoine Marie
6c37311e38 ppBSE GT 2024-10-30 09:36:36 +01:00
9b32dbd749 fix stupid bug in UGW static kernel 2024-10-30 09:28:39 +01:00
Antoine Marie
61288e474d ppBSE dynamic correction for the block D is working 2024-10-25 14:44:35 +02:00
Antoine Marie
7c972806a0 Merge branch 'master' of github.com:pfloos/QuAcK 2024-10-23 18:07:04 +02:00
ba01dd71fa looking for a bug in UGW_phBSE 2024-10-15 02:14:51 +08:00
2472e632f8 fixing UGW_phBSE and UGW_phACFDT 2024-10-14 04:11:48 +02:00
96100f5cfd remove ccGW for now 2024-10-11 15:34:35 +02:00
Antoine Marie
eca55bbcd8 save modified file to pull 2024-10-10 09:53:32 +02:00
Pierre-Francois Loos
da6dada877 clean GTpp in progress but unfinished 2024-10-01 16:14:33 +02:00
Pierre-Francois Loos
75479f07f2 proper spin adaptation in GTpp 2024-10-01 14:42:37 +02:00
19be97355d saving 2024-10-01 09:42:25 +02:00
172ca40f37 saving worj in ccGW 2024-09-30 23:06:00 +02:00
Pierre-Francois Loos
80f393ded2 typo flow RG0W0 2024-09-27 15:31:38 +02:00
ccd4ad570b saving work in ppBSE@GW 2024-09-26 23:04:45 +02:00
Pierre-Francois Loos
b103364b76 mess 2024-09-26 20:06:23 +02:00
Pierre-Francois Loos
3494a6605a missing file 2024-09-26 19:54:04 +02:00
Pierre-Francois Loos
26fde9363c debugging uf ppBSE 2024-09-26 17:55:06 +02:00
Pierre-Francois Loos
88b0424cd3 GGW ppBSE dyn 2024-09-26 14:26:52 +02:00
Pierre-Francois Loos
dc0f77d525 uf ppBSE 2024-09-24 17:18:45 +02:00
27a1aaa5e9 cleanup 2024-09-19 20:38:18 +02:00
Pierre-Francois Loos
486fde26d5 new logo 2024-09-19 17:09:20 +02:00
f6b18f3c2a eomGW 2024-09-18 18:08:24 +02:00
8f94e0abdd clean up in ccG0W0 2024-09-17 20:15:06 +02:00
0e43294211 clean up in ccG0W0 2024-09-17 20:13:18 +02:00
42f5439924 ccG0W0 with minimal memory and DIIS 2024-09-17 19:12:45 +02:00
Pierre-Francois Loos
2fd282fcce saving wok in ccGW 2024-09-17 17:17:57 +02:00
Pierre-Francois Loos
8b7c715811 more efficient ccG0W0 2024-09-17 16:39:38 +02:00
Pierre-Francois Loos
4fa5706b90 ccRG0W0 2024-09-17 14:31:48 +02:00
5fa70be11e ok with ccGW 2024-09-17 09:10:16 +02:00