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mirror of https://github.com/pfloos/quack synced 2024-07-12 22:24:44 +02:00
Commit Graph

804 Commits

Author SHA1 Message Date
4de7d1882d fix bug in HF diis 2023-07-23 22:03:42 +02:00
eb59072a2c cleanup 2023-07-23 18:03:15 +02:00
f515261c88 GT and GW modules 2023-07-23 17:41:44 +02:00
aa1d3c90bc module GF 2023-07-23 11:58:18 +02:00
ed08450661 RPA module 2023-07-23 11:16:42 +02:00
d91f343713 fix bug in CI module 2023-07-23 10:40:39 +02:00
f5f34d9668 CI module 2023-07-23 10:29:24 +02:00
75f4839725 create CC module 2023-07-22 22:19:46 +02:00
b5ccfb734a remove Vxc and SigX and rename routines in UGT 2023-07-22 21:40:19 +02:00
1ea1d49a4e rename UGF routines 2023-07-22 21:02:59 +02:00
3a18f3e28a rename UAC routines 2023-07-22 19:41:45 +02:00
09e04f3f53 bug in qsGW 2023-07-22 11:49:06 +02:00
b010c872fc remove COHSEX completely 2023-07-21 22:54:53 +02:00
34fb993302 clean up GTeh 2023-07-21 20:38:49 +02:00
c476b258ff rename ULR routines 2023-07-21 13:04:29 +02:00
5660146de5 clean up GW and GT 2023-07-21 12:30:29 +02:00
1d9725546d fix bug in ppBSE 2023-07-21 12:00:08 +02:00
d11bebafe1 fix bug in non-TDA dBSE@GW 2023-07-21 11:28:12 +02:00
6cc9802d00 include B term in phBSE2@GW 2023-07-21 11:18:00 +02:00
d7e059c330 remove useless routines in dBSE@GW 2023-07-21 10:47:36 +02:00
d8678bfe4f fix bug in dBSE@GW 2023-07-21 10:45:10 +02:00
6c4d0c7544 Merge branch 'master' of github.com:pfloos/QuAcK 2023-07-21 10:22:00 +02:00
46ab457dc2 remove evDyn and cleanup dBSE@GW 2023-07-21 10:21:54 +02:00
d310754ed1
Update README.md 2023-07-20 22:19:17 +02:00
b53a1505be remove useless routines in utils 2023-07-20 22:17:47 +02:00
e6d68ea534 remove static_screening 2023-07-20 22:09:12 +02:00
752edf29bf cleanup LR 2023-07-20 22:01:11 +02:00
6df119aaba move exchange 2023-07-20 21:54:31 +02:00
4e7cb25352 move exchange 2023-07-20 21:54:09 +02:00
5f0fad74d4 remove QP_roots 2023-07-20 21:51:58 +02:00
600eb557b2 remove plot_GW 2023-07-20 21:50:41 +02:00
3103f786d6 fix bug 2023-07-20 16:03:09 +02:00
7d0541778b rename kernel routines 2023-07-20 15:54:24 +02:00
63ab549f6b ppLR in GTpp and GW 2023-07-20 14:59:02 +02:00
ad174054bb Merge branch 'master' of github.com:pfloos/QuAcK 2023-07-20 12:38:02 +02:00
11794c6625 ok with linear response 2023-07-20 12:37:54 +02:00
7cee56a848
Update README.md 2023-07-20 09:54:12 +02:00
e7cc1fb8a5 logo 2023-07-20 09:53:25 +02:00
ba40c9bdb8 remove XBSE 2023-07-19 11:40:22 +02:00
ac0b9336df clean up LR in GW mess 2023-07-19 11:03:55 +02:00
0b72047ab3 phLR in GTeh 2023-07-18 22:17:42 +02:00
e150460d22 missing files 2023-07-18 15:07:39 +02:00
7b06e8ea50 fix bug in dSigmaC 2023-07-18 15:07:07 +02:00
1b839647e3 remove COHSEX and modify phLR in GW routines 2023-07-18 15:00:16 +02:00
a2c38aa03b remove COHSEX and modify phLR in GW routines 2023-07-18 14:59:18 +02:00
092a3f5e6d OK with LR in RPA routines 2023-07-18 11:53:38 +02:00
266be65f2e OK for ppLR 2023-07-18 09:59:25 +02:00
b4d96d1065 Merge branch 'master' of github.com:pfloos/QuAcK 2023-07-18 09:20:15 +02:00
65ddd8df20 remove MO.dat 2023-07-18 09:20:07 +02:00
5705e5d29c
Update README.md 2023-07-18 09:07:50 +02:00