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fc73914faa
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graphical GW
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2020-03-12 15:04:16 +01:00 |
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63e6be3b2c
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BSE clean up
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2020-03-11 16:41:20 +01:00 |
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9e3c3f9c89
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eta in linear response
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2020-01-23 21:22:41 +01:00 |
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76aa00962d
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nS
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2020-01-22 09:20:18 +01:00 |
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22d83c824f
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new files
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2020-01-17 15:31:38 +01:00 |
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847160ad09
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basis
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2020-01-17 13:57:03 +01:00 |
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8dfd69db80
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exchange kernel
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2020-01-16 21:39:00 +01:00 |
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c2ac210e4c
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create BSE standalone routine
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2020-01-14 21:27:34 +01:00 |
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d84cff37b2
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rename TDHF and co
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2020-01-14 19:53:52 +01:00 |
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51016fd5c1
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clean up + AC
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2020-01-14 14:44:01 +01:00 |
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c6ec8f91e9
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RPA and ACRPA
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2020-01-13 23:08:03 +01:00 |
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1acf76b156
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remove ERI copy in qsGW
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2019-10-30 10:31:05 +01:00 |
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72abe8a4f6
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bug
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2019-10-28 16:34:09 +01:00 |
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877f78f1a5
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T-matrix in spinorbitals
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2019-10-22 23:03:01 +02:00 |
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8e07edaae0
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G0T0 bug and clean up
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2019-10-18 23:16:37 +02:00 |
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6e3abd8927
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starting G0T0
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2019-10-16 18:14:47 +02:00 |
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0c6f1ee7d5
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ppRPA done
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2019-10-15 23:13:00 +02:00 |
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f8a9321cf0
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pp-RPA starting to be OK
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2019-10-15 17:56:27 +02:00 |
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a5047e9b1a
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T-matrix self-energy
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2019-10-06 22:35:36 +02:00 |
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923d1a8bd6
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pp-RPA
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2019-10-05 23:09:20 +02:00 |
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8dbd12ecac
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eta parameter
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2019-09-22 21:15:53 +02:00 |
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b7475c58cf
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huckel guess
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2019-09-20 22:28:01 +02:00 |
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2feb62101d
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GW correction
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2019-07-09 23:09:32 +02:00 |
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ba070b3484
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GW correction
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2019-07-09 17:25:21 +02:00 |
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c477b848ac
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basis correction
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2019-07-09 16:17:10 +02:00 |
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b18613c763
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TDHF Ec
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2019-05-23 09:53:23 +02:00 |
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bfe2f78b66
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add lib directory
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2019-05-08 09:10:46 +02:00 |
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bd44ad4ffb
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correcting bug in read_integrals
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2019-05-08 08:59:26 +02:00 |
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ce7d0118ab
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sph ready
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2019-05-07 22:55:36 +02:00 |
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b93ee21573
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fix bug in GF2
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2019-04-29 09:52:21 +02:00 |
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dd2ee22779
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time QuAcK
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2019-04-24 18:00:54 +02:00 |
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a03e011301
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sph ready
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2019-04-24 15:33:04 +02:00 |
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deb5144161
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sph int
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2019-04-18 23:22:23 +02:00 |
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31e3707ce6
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Sph
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2019-04-02 22:58:24 +02:00 |
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881220a97f
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fix DIIS in GW
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2019-04-01 15:53:39 +02:00 |
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a34e444fa0
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EOM-CC under way
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2019-03-19 23:02:22 +01:00 |
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3ee4b0855a
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xcDFT -> eDFT
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2019-03-19 11:33:49 +01:00 |
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599182f5e5
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UHF is working
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2019-03-19 11:21:34 +01:00 |
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4c821fe4ac
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cleanup
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2019-03-19 10:13:33 +01:00 |
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