 Pierre-Francois Loos
|
04c70f18d8
|
minimal changes in many files
|
2023-12-03 18:47:30 +01:00 |
|
Pierre-Francois Loos
|
19fd073ab9
|
fix bug in sort_ppRPA
|
2023-11-29 16:20:53 +01:00 |
|
Pierre-Francois Loos
|
ebd00ae525
|
clean up print excitation energy
|
2023-11-22 10:07:23 +01:00 |
|
Pierre-Francois Loos
|
3318daf241
|
plenty of CC for GHF reference
|
2023-11-13 22:15:00 +01:00 |
|
Pierre-Francois Loos
|
8a5e094278
|
include test in many different things... work on progress
|
2023-11-13 16:15:15 +01:00 |
|
Pierre-Francois Loos
|
0b892dbe31
|
restructuration QuAcK for restricted and unrestricted branches
|
2023-10-25 21:38:20 +02:00 |
|
Pierre-Francois Loos
|
28e8b5c2cc
|
remove ROpCCD
|
2023-10-02 21:54:10 +02:00 |
|
Pierre-Francois Loos
|
cf3b2cba58
|
fix QP graph in GW
|
2023-10-02 21:37:25 +02:00 |
|
Pierre-Francois Loos
|
07208d9b68
|
remove pCCDso
|
2023-09-06 11:19:01 +02:00 |
|
Pierre-Francois Loos
|
99cbd0e95d
|
ROHF not yet debugged
|
2023-09-05 17:23:40 +02:00 |
|
Pierre-Francois Loos
|
0dfa3b0071
|
clean up in RPA
|
2023-07-31 16:01:12 +02:00 |
|
Pierre-Francois Loos
|
e409b30699
|
fix printing bug
|
2023-07-30 22:14:28 +02:00 |
|
Pierre-Francois Loos
|
4576ee06c3
|
rename LR routines
|
2023-07-28 14:14:35 +02:00 |
|
Pierre-Francois Loos
|
d738e335ba
|
clean up
|
2023-07-27 11:38:38 +02:00 |
|
Pierre-Francois Loos
|
75f4839725
|
create CC module
|
2023-07-22 22:19:46 +02:00 |
|
Pierre-Francois Loos
|
e6d68ea534
|
remove static_screening
|
2023-07-20 22:09:12 +02:00 |
|
Pierre-Francois Loos
|
ac0b9336df
|
clean up LR in GW mess
|
2023-07-19 11:03:55 +02:00 |
|
Pierre-Francois Loos
|
d207fb5173
|
renaming LR routines and fix bug in Z GW
|
2023-07-12 13:34:10 +02:00 |
|
Pierre-Francois Loos
|
86ae96511b
|
rename GW routines
|
2023-07-04 10:51:03 +02:00 |
|
Pierre-Francois Loos
|
e41097e8c2
|
reversing loops in HF
|
2022-12-10 09:03:28 +01:00 |
|
Pierre-Francois Loos
|
c130e3a352
|
fix bug in CCGW
|
2022-12-06 09:15:32 +01:00 |
|
Pierre-Francois Loos
|
b5499435ae
|
numgrid install problem
|
2022-10-20 16:20:59 +02:00 |
|
Pierre-Francois Loos
|
37030fe797
|
CCGW
|
2022-10-13 21:20:37 +02:00 |
|
Pierre-Francois Loos
|
f9497363b2
|
CCGW
|
2022-09-29 16:01:02 +02:00 |
|
Pierre-Francois Loos
|
96621bd038
|
adding routines for MBPT vs CC
|
2022-09-28 16:09:09 +02:00 |
|
Pierre-Francois Loos
|
69bab74d81
|
EE-EOM-CCD
|
2022-09-27 16:43:24 +02:00 |
|
Pierre-Francois Loos
|
1f2f6634bb
|
DIP- and DEA-EOM-CCD
|
2022-09-27 14:07:31 +02:00 |
|
Pierre-Francois Loos
|
68008e5738
|
working on ppBSE@GT
|
2022-09-09 21:48:50 +02:00 |
|
Pierre-Francois Loos
|
3ecf94bbc9
|
debugging BSE@GT
|
2022-01-05 12:46:59 +01:00 |
|
Pierre-Francois Loos
|
3dfc2c3526
|
crossed ring CC and RPA working
|
2021-11-10 14:47:26 +01:00 |
|
Pierre-Francois Loos
|
cec0fe9205
|
working on RPA third channel
|
2021-11-10 09:42:30 +01:00 |
|
Pierre-Francois Loos
|
ac5955ab27
|
fix print in CCSD
|
2021-11-06 14:36:54 +01:00 |
|
Pierre-Francois Loos
|
724284fe0c
|
FB
|
2021-01-05 16:29:25 +01:00 |
|
Pierre-Francois Loos
|
e793ceaeca
|
BCCD start
|
2021-01-05 15:51:52 +01:00 |
|
Pierre-Francois Loos
|
469475ef5f
|
DCD
|
2020-12-04 13:26:08 +01:00 |
|
Pierre-Francois Loos
|
5b4dd9982c
|
fix bug in pCC
|
2020-11-05 15:51:33 +01:00 |
|
Pierre-Francois Loos
|
efaf67b649
|
FC for CCD
|
2020-10-19 14:20:35 +02:00 |
|
Pierre-Francois Loos
|
7af5a35157
|
bug in makefile debug
|
2020-10-14 16:02:09 +02:00 |
|
Pierre-Francois Loos
|
96254cd22d
|
remove examples dir
|
2020-10-14 15:07:35 +02:00 |
|
Pierre-Francois Loos
|
a5bd9c218b
|
ninja
|
2020-10-13 13:44:24 +02:00 |
|
Pierre-Francois Loos
|
85fd543d1b
|
clean up pCCD
|
2020-10-08 17:19:48 +02:00 |
|
Pierre-Francois Loos
|
c15ea00351
|
CIS(D) sligntly faster
|
2020-10-02 13:42:21 +02:00 |
|
Pierre-Francois Loos
|
680f4cb0e2
|
debugging sf
|
2020-09-30 09:59:18 +02:00 |
|
Pierre-Francois Loos
|
2a498658b3
|
major modification for makefiles
|
2020-09-30 00:10:57 +02:00 |