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mirror of https://github.com/pfloos/quack synced 2024-11-07 06:33:55 +01:00
Commit Graph

1230 Commits

Author SHA1 Message Date
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
6ad0cedc6e saving work in CCGW 2024-09-16 23:32:38 +02:00
94f5fd416f CC-based GW 2024-09-16 22:30:23 +02:00
Pierre-Francois Loos
81257ad362 working in CCGW 2024-09-16 16:00:04 +02:00
Pierre-Francois Loos
4d66fbc20d working in CCGW 2024-09-16 15:59:16 +02:00
Pierre-Francois Loos
37d312c789 ppBSE upfolded 2024-09-16 11:00:19 +02:00
32998c8a32 symmetrized upfolded phBSE scheme 2024-09-14 23:25:38 +02:00
c03e607ede ppBSE upfolded written 2024-09-13 23:22:48 +02:00
Pierre-Francois Loos
767db708c9 working on ufBSE 2024-09-13 16:22:15 +02:00
Pierre-Francois Loos
180ed63d74 fix bug 2024-09-13 09:52:31 +02:00
Pierre-Francois Loos
77fea9a9bd redefine ppLR matrix 2024-09-13 09:33:43 +02:00
ac03c0e109 Merge branch 'master' of github.com:pfloos/QuAcK 2024-09-12 22:01:13 +02:00
647f27fb62 ok with RG0T0pp now 2024-09-12 22:01:06 +02:00
976c3d2cbb
Update README.md 2024-09-12 21:24:53 +02:00
8ec7d3d170 new routine to fix GTpp 2024-09-12 20:10:02 +02:00
Pierre-Francois Loos
6290634d87 fix bug in sort_ppRPA 2024-09-12 17:14:04 +02:00
Pierre-Francois Loos
ff7cff0963 fix bug in ppBSE dynamic kernel and subroutine names 2024-09-12 15:46:11 +02:00
90cc34c81a forget print file 2024-09-11 22:14:30 +02:00
568507a183 ok for now with SRG 2024-09-11 22:13:45 +02:00
d1c29af200 fix bug in SRG in U branch 2024-09-11 21:58:25 +02:00
d63472bb0b fix bug in SRG 2024-09-11 21:40:38 +02:00
bf77863d6c QP search for SRG done 2024-09-11 20:35:07 +02:00
04a42701e2 working on SRG for GW 2024-09-11 18:41:27 +02:00
6a7b0337d9 remove more SRG 2024-09-11 17:59:28 +02:00
9f98f7b856 remove SRG-qsGW methods 2024-09-11 17:58:36 +02:00
c2d92e2299 UGW_SRG 2024-09-11 17:21:43 +02:00
da7bdcd809 fusion SRG into qsGW 2024-09-11 15:09:40 +02:00
9ce21a9d2b Merge branch 'master' of github.com:pfloos/QuAcK 2024-09-11 11:39:13 +02:00
eb6f35a799 starting cleaning SRG 2024-09-11 11:39:03 +02:00
Abdallah Ammar
ab4cca296e fixed openmp bug 2024-09-11 10:51:37 +02:00