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mirror of https://github.com/pfloos/quack synced 2024-12-23 04:43:42 +01:00
Commit Graph

31 Commits

Author SHA1 Message Date
Pierre-Francois Loos
34fba9ed9c remove RMP3 2024-09-10 17:08:16 +02:00
Abdallah Ammar
4d8adcd6a2 fixed bug in RMP call 2024-09-01 15:07:01 +02:00
Abdallah Ammar
e91ef9dfeb introduce nBas_MOs in RCC 2024-08-28 19:52:07 +02:00
04c70f18d8 minimal changes in many files 2023-12-03 18:47:30 +01:00
19fd073ab9 fix bug in sort_ppRPA 2023-11-29 16:20:53 +01:00
Pierre-Francois Loos
ff8557b684 modify print in test 2023-11-14 14:31:27 +01:00
436231df11 introduce test in MP and RPA 2023-11-11 23:00:00 +01:00
ef528e6a3c rename RMP routines and fix bug 2023-11-11 21:43:35 +01:00
Pierre-Francois Loos
a60aa8d8ee GMP3 and GG0F2 2023-10-27 13:35:10 +02:00
7e08e6abbd GMP2 2023-10-26 22:24:22 +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
75f4839725 create CC module 2023-07-22 22:19:46 +02:00
760e5ebb8d clean up ppACFDT 2023-07-17 14:50:16 +02:00
95807231fe add MP module 2023-07-17 14:21:39 +02:00
a2ab1fa782 remove MP2F12 2023-07-17 14:09:29 +02:00
db1733088a renaming in HF and MP variables 2023-07-17 13:51:52 +02:00
196e4c917a introduce SRG regularizer in GF, GW, and GT and add option for reg MP2 2022-11-30 17:18:51 +01:00
a64bdce3c4 regularized GW 2021-12-16 14:47:13 +01:00
e006fb5a01 regularized MP2 2021-12-16 14:24:02 +01:00
d01e7c248c debug qsGF2/qsUGF2 2021-03-23 19:50:46 +01:00
29ed74cba0 qsUGF2 2021-03-07 22:44:37 +01:00
75ec2443c1 stability analysis 2021-03-03 11:37:46 +01:00
a5cf80f709 FC for MP3 2020-10-19 13:57:56 +02:00
7af5a35157 bug in makefile debug 2020-10-14 16:02:09 +02:00
96254cd22d remove examples dir 2020-10-14 15:07:35 +02:00
a5bd9c218b ninja 2020-10-13 13:44:24 +02:00
c15ea00351 CIS(D) sligntly faster 2020-10-02 13:42:21 +02:00
680f4cb0e2 debugging sf 2020-09-30 09:59:18 +02:00
2a498658b3 major modification for makefiles 2020-09-30 00:10:57 +02:00