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mirror of https://github.com/pfloos/quack synced 2024-06-02 11:25:28 +02:00
Commit Graph

331 Commits

Author SHA1 Message Date
4d6e969a54 ECMD 2019-07-15 12:07:54 +02:00
ab7a4609b7 GW correction 2019-07-09 23:10:22 +02:00
2feb62101d GW correction 2019-07-09 23:09:32 +02:00
7377e5e649 GW correction 2019-07-09 17:26:36 +02:00
ba070b3484 GW correction 2019-07-09 17:25:21 +02:00
c477b848ac basis correction 2019-07-09 16:17:10 +02:00
b18613c763 TDHF Ec 2019-05-23 09:53:23 +02:00
bfe2f78b66 add lib directory 2019-05-08 09:10:46 +02:00
b05d50eaa6 correcting bug in MOM 2019-05-08 09:06:14 +02:00
bd44ad4ffb correcting bug in read_integrals 2019-05-08 08:59:26 +02:00
ce7d0118ab sph ready 2019-05-07 22:55:36 +02:00
f345b8e2be BSE Ec 2019-05-04 17:13:50 +02:00
634e0ecf09 fix bug in GF3 2019-04-29 09:54:36 +02:00
b93ee21573 fix bug in GF2 2019-04-29 09:52:21 +02:00
a963b22293 debugging 2019-04-29 09:43:33 +02:00
dd2ee22779 time QuAcK 2019-04-24 18:00:54 +02:00
a03e011301 sph ready 2019-04-24 15:33:04 +02:00
042d6ac8ff fix CC 2019-04-19 10:31:14 +02:00
deb5144161 sph int 2019-04-18 23:22:23 +02:00
31e3707ce6 Sph 2019-04-02 22:58:24 +02:00
8ad895ad85 cleanup excitation_energy 2019-04-02 09:59:30 +02:00
8a8e4a939c excitation energy 2019-04-01 16:32:55 +02:00
881220a97f fix DIIS in GW 2019-04-01 15:53:39 +02:00
0405a53fa8 typos EOM 2019-03-20 21:00:05 +01:00
ca3a985d50 create utils 2019-03-20 13:38:42 +01:00
9a3691eff0 EOM-CC under way 2019-03-19 23:02:47 +01:00
a34e444fa0 EOM-CC under way 2019-03-19 23:02:22 +01:00
3ee4b0855a xcDFT -> eDFT 2019-03-19 11:33:49 +01:00
599182f5e5 UHF is working 2019-03-19 11:21:34 +01:00
a8dba8205c removing SP files 2019-03-19 10:15:55 +01:00
4c821fe4ac cleanup 2019-03-19 10:13:33 +01:00