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Commit Graph

181 Commits

Author SHA1 Message Date
404746ad04 LIM 2020-03-18 11:10:21 +01:00
2fdc2b2978 print energies 2020-03-18 07:29:54 +01:00
a5163dbbcb Debug in progress 2020-03-17 22:39:04 +01:00
954e6d2a29 RMFL20 done 2020-03-17 19:35:00 +01:00
c7434afdc2 eLDA correlation potential under work 2020-03-17 11:50:11 +01:00
871f11ef40 eLDA correlation potential under work 2020-03-17 11:50:05 +01:00
52fe50f992 DD eLDA 2020-03-17 11:29:29 +01:00
ddc92cfd81 DD eLDA 2020-03-17 11:29:20 +01:00
0667c8c5fd individual energies for lda correlation 2020-03-16 23:28:56 +01:00
b9d0e40407 more rm LZ 2020-03-16 22:10:42 +01:00
0a2211fa4c rm LZ 2020-03-16 22:08:33 +01:00
f1b681b90a commit b4 removing LZ routines 2020-03-16 22:08:04 +01:00
9bf424feab rename routines 2020-03-16 10:48:54 +01:00
642a217564 restricted formalism 2020-03-15 22:37:40 +01:00
c947c6cf1d restricted individual energies 2020-03-15 21:48:00 +01:00
444a9f7bf1 RVWN5 2020-03-15 20:33:18 +01:00
81ca41a2f6 restricted subroutines 2020-03-15 16:30:18 +01:00
3502e5729e workin on restricted 2020-03-15 16:29:43 +01:00
b7474b4a60 R and U density matrices 2020-03-15 14:34:18 +01:00
f8bdfb1ceb R and U density matrices 2020-03-15 14:33:53 +01:00
e14e8ac278 R or U 2020-03-15 08:24:15 +01:00
6cff7ad77a starting modifying code for clotilde 2020-03-15 08:23:01 +01:00
0be0d5d8c3 revive eDFT code 2020-03-14 23:00:44 +01:00
349b5439dd scan 2019-10-06 22:39:11 +02:00
c477b848ac basis correction 2019-07-09 16:17:10 +02:00
ad3d77cda6 adding files 2019-05-07 22:57:57 +02:00
84e906db3e DFT grid 2019-03-20 21:01:34 +01:00
b5a19f38ee DFT grid 2019-03-20 21:01:09 +01:00
0405a53fa8 typos EOM 2019-03-20 21:00:05 +01:00
ca3a985d50 create utils 2019-03-20 13:38:42 +01:00
3ee4b0855a xcDFT -> eDFT 2019-03-19 11:33:49 +01:00