10
1
mirror of https://github.com/pfloos/quack synced 2024-12-25 13:53:41 +01:00
Commit Graph

25 Commits

Author SHA1 Message Date
e793ceaeca BCCD start 2021-01-05 15:51:52 +01:00
e0a28f71bd print qsUGW 2020-12-10 09:19:58 +01:00
fedc3a5d23 removing GM correlation energy in qsGW 2020-11-04 15:25:53 +01:00
64f02d427a debug GM correlation energy 2020-11-04 14:49:45 +01:00
f44ab1eadb debug GM correlation energy 2020-11-04 14:47:45 +01:00
6061f1b507 clean up print GW 2020-11-03 22:07:16 +01:00
5df03b58ac bug fix in qsUGW 2020-11-03 21:47:57 +01:00
e26c052a17 print qsUGW 2020-10-21 20:53:36 +02:00
d6723f332d qsUGW works 2020-10-21 12:59:02 +02:00
b75798078b qsUGW works 2020-10-21 12:58:37 +02:00
2e6662056c working on qsUGW 2020-10-21 12:09:18 +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
1abe13c86d Done with UACFDT 2020-10-07 22:51:30 +02:00
efbe27068e unrestricted ACFDT 2020-10-07 18:26:24 +02:00
dbd15c2dae bug fix in sf-BSE-dyn 2020-10-06 16:15:47 +02:00
3433e3f99e sf-BSE 2020-10-06 14:24:54 +02:00
73e6c58852 S^2 spin flip almost OK 2020-10-05 23:00:56 +02:00
3d2ca7529f spin flip for CIS and TDHF almost done 2020-10-05 16:58:19 +02:00
c15ea00351 CIS(D) sligntly faster 2020-10-02 13:42:21 +02:00
ac66ae8ea2 corrected bug in spin flip 2020-09-30 15:02:48 +02:00
680f4cb0e2 debugging sf 2020-09-30 09:59:18 +02:00
11f0ded287 UBSE dynamic OK for spin-conserving transitions 2020-09-30 00:13:47 +02:00
2a498658b3 major modification for makefiles 2020-09-30 00:10:57 +02:00