|
AOtoMO
|
move exchange
|
2023-07-20 21:54:31 +02:00 |
|
CC
|
clean up
|
2023-07-27 11:38:38 +02:00 |
|
CI
|
RPA module
|
2023-07-23 11:16:42 +02:00 |
|
GF
|
updating Z in QP roots
|
2023-07-27 21:23:40 +02:00 |
|
GT
|
updating Z in QP roots
|
2023-07-27 21:23:40 +02:00 |
|
GW
|
updating Z in QP roots
|
2023-07-27 21:23:40 +02:00 |
|
HF
|
fix bug in HF diis
|
2023-07-23 22:03:42 +02:00 |
|
LR
|
add S2
|
2023-07-27 11:38:56 +02:00 |
|
MP
|
create CC module
|
2023-07-22 22:19:46 +02:00 |
|
QuAcK
|
rename n_diis in max_diis in read_options
|
2023-07-23 22:05:38 +02:00 |
|
RPA
|
RPA module
|
2023-07-23 11:16:42 +02:00 |
|
utils
|
remove useless routines in utils
|
2023-07-20 22:17:47 +02:00 |
|
.gitignore
|
int directory
|
2020-10-13 20:59:03 +02:00 |
|
eDFT.tgz
|
remove eDFT
|
2023-07-03 14:41:46 +02:00 |
|
make_ninja.py
|
remove qcaml for pyscf
|
2023-07-03 14:33:48 +02:00 |
|
Makefile
|
Linux
|
2020-10-14 17:09:07 +02:00 |
