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mirror of https://github.com/pfloos/quack synced 2024-07-05 10:56:01 +02:00
Commit Graph

77 Commits

Author SHA1 Message Date
Pierre-Francois Loos
717138f363 starting cleaning up the unrestricted branch 2023-11-10 14:37:49 +01:00
Pierre-Francois Loos
a60aa8d8ee GMP3 and GG0F2 2023-10-27 13:35:10 +02:00
c7093e0c2c BSE@GHF 2023-10-26 23:28:53 +02:00
Pierre-Francois Loos
5b8c0d542c post-GHF methods 2023-10-26 18:00:16 +02:00
0b892dbe31 restructuration QuAcK for restricted and unrestricted branches 2023-10-25 21:38:20 +02:00
0dfa3b0071 clean up in RPA 2023-07-31 16:01:12 +02:00
68e6f02ae2 clean print excitations 2023-07-28 14:35:14 +02:00
4576ee06c3 rename LR routines 2023-07-28 14:14:35 +02:00
eee5f6bac8 rename UGW routines 2023-07-27 21:59:18 +02:00
ed08450661 RPA module 2023-07-23 11:16:42 +02:00
3a18f3e28a rename UAC routines 2023-07-22 19:41:45 +02:00
c476b258ff rename ULR routines 2023-07-21 13:04:29 +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
8c0a682aed rename ACFDT routines 2023-07-17 15:17:25 +02:00
1f8dcf8db5 rename ACFDT routines 2023-07-17 15:17:02 +02:00
760e5ebb8d clean up ppACFDT 2023-07-17 14:50:16 +02:00
ae540679cd more renaming 2023-07-12 23:16:37 +02:00
69faf94a4f renaming again 2023-07-12 22:56:20 +02:00
76bc19504d rename LR matrices 2023-07-12 22:37:04 +02:00
d207fb5173 renaming LR routines and fix bug in Z GW 2023-07-12 13:34:10 +02:00
86ae96511b rename GW routines 2023-07-04 10:51:03 +02:00
812721e5d9 rename GTpp routines 2023-07-04 10:32:47 +02:00
af5d4f4226 fixing antoine 2023-07-02 16:21:14 +02:00
Antoine Marie
545b5fb5e2 trying to fix diverging version 2023-06-30 16:47:26 +02:00
Antoine Marie
552005f910 dgemm instead of matmul for nVV matrix multiplication in sort_ppRPA.f90 2023-06-14 16:53:16 +02:00
5a561e0ed9 update eDFT module 2022-11-28 10:52:06 +01:00
96621bd038 adding routines for MBPT vs CC 2022-09-28 16:09:09 +02:00
1f2f6634bb DIP- and DEA-EOM-CCD 2022-09-27 14:07:31 +02:00
68008e5738 working on ppBSE@GT 2022-09-09 21:48:50 +02:00
13ed518704 correct a few bugs in ppBSE 2022-08-17 16:53:59 +02:00
3acc640eee excitation vectors for ppRPA and ppBSE 2022-08-17 15:52:13 +02:00
86f501cb78 ppURPA 2022-02-15 13:51:18 +01:00
21c1ceb975 fix ACFDT for Tmatrix 2022-02-03 10:05:58 +01:00
a1e81ab7e5 clean BSE2 2022-02-01 11:42:31 +01:00
f7718c8ab1 clean linear response and static BSE2 kernel 2022-01-31 13:19:42 +01:00
23e520cea9 ppURPA cleaner 2022-01-29 13:51:06 +01:00
0924ce1b3d clean ppURPA 2022-01-29 11:47:35 +01:00
3ecf94bbc9 debugging BSE@GT 2022-01-05 12:46:59 +01:00
c7d353de18 rename files in GT 2022-01-02 10:25:19 +01:00
97c274a4f1 rename files in GT 2022-01-02 10:24:30 +01:00
d6ee3863da ppURPA 2021-12-31 12:49:13 +01:00
55187b39c4 ppURPA updates 2021-12-16 12:28:28 +01:00
5d5824ce14 ppURPA 2021-12-15 11:41:06 +01:00
3d3806da64 ppURPA 2021-12-13 14:28:05 +01:00
aadf942f83 curvature corrected functional revisited 2021-11-24 10:25:48 +01:00
c379b80eac ACFDT for ppRPA 2021-11-18 13:34:08 +01:00
6f886a61a6 crossed ring ACFDT 2021-11-10 22:53:50 +01:00
23d7d83091 working on ACFDT for T-matrix 2021-11-10 22:41:40 +01:00