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494204113b
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new version of SOSEX (need serious debugging)
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2021-10-22 21:10:31 +02:00 |
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52a7e632c4
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fix form of the dynamical T-matrix
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2021-10-20 23:19:27 +02:00 |
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7fd40afee5
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ufBSE
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2021-10-19 18:07:44 +02:00 |
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87d4c8ac9a
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fixing bug in BSE@GT
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2021-10-19 14:09:33 +02:00 |
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871e657d08
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AC@BSE@GT
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2021-10-18 23:12:43 +02:00 |
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22aeccb222
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TDA in pp-RPA and GT
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2021-10-18 22:05:26 +02:00 |
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6f11f0909f
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clean up pp-RPA
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2021-10-18 21:41:03 +02:00 |
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27181b85e4
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adding ufGW to methods
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2021-10-18 21:11:01 +02:00 |
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75b35bf3dd
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adding Z in ufGW
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2021-10-18 15:05:01 +02:00 |
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58044a8a89
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OK for ufGW
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2021-10-18 14:14:46 +02:00 |
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d038594640
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ufGW
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2021-10-18 10:10:54 +02:00 |
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90a3570323
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evGT
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2021-10-17 23:04:22 +02:00 |
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cb67629aed
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dBSE@GT
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2021-10-17 12:49:40 +02:00 |
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0ec1dc47de
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dBSE@GT
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2021-10-17 12:46:47 +02:00 |
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35d31cf705
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dBSE@GT
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2021-10-17 10:06:57 +02:00 |
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af73b5bfdb
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saving debug
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2021-10-17 08:47:51 +02:00 |
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4fd4d88514
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now debugging dBSE@GT
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2021-10-17 08:15:26 +02:00 |
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457c69bcce
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dynamical correction for BSE@GT
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2021-10-17 08:11:17 +02:00 |
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beaba5f152
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more cleaning for GT
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2021-10-16 19:43:40 +02:00 |
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41f48188d5
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clean up code for GT
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2021-10-16 18:51:53 +02:00 |
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7c863d4982
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OK for BSE@evGT
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2021-10-16 15:36:24 +02:00 |
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0fa90ab2a9
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OK for BSE@GT
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2021-10-16 15:34:34 +02:00 |
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ec4ff2cc9f
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debugging BSE@GT
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2021-10-15 22:32:22 +02:00 |
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eda79e42ec
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code done in BSE@GT
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2021-10-15 16:56:16 +02:00 |
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feb1a1bb40
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working on BSE@GT
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2021-10-15 13:51:04 +02:00 |
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35f1ba916b
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fix bug in evGT
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2021-09-27 15:57:26 +02:00 |
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ab45790280
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correcting printing error in G0W0
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2021-09-09 15:10:19 +02:00 |
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3349b92e55
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add G0T0
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2021-07-06 11:57:13 +02:00 |
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9eca749bce
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qsGW
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2021-06-25 10:19:42 +02:00 |
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4cd96d2aa4
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OK for RPA/RPAx/GW
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2021-04-02 09:53:23 +02:00 |
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246f4dea48
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add G0W0
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2021-03-27 15:04:18 +01:00 |
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114ac2d1d1
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debug qsGW and qsGF
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2021-03-27 15:03:54 +01:00 |
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ed2992bc85
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clean up qsGW print
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2021-03-23 22:35:46 +01:00 |
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b5a28cca0d
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EcGM
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2021-03-15 15:43:51 +01:00 |
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72470287f7
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UG0F2
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2021-03-08 17:00:05 +01:00 |
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3ced7a8846
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GF move
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2021-03-07 17:17:18 +01:00 |
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7fd5abe76f
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clean up GM again
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2021-03-06 23:08:43 +01:00 |
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96fa82931d
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GF2 clean up
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2021-03-06 15:27:35 +01:00 |
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ab7cf0401e
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qsGF2
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2021-03-05 22:34:48 +01:00 |
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cecaf03c57
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static screening
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2021-03-05 17:29:52 +01:00 |
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75ec2443c1
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stability analysis
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2021-03-03 11:37:46 +01:00 |
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5f55c1af4d
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fixing up qsGW Ec
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2021-03-01 14:55:29 +01:00 |
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272e47ed27
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UVWN3 for Gaussian B3LYP
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2021-02-25 10:55:08 +01:00 |
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ba7a2349af
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fix QP graph
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2021-02-15 22:15:30 +01:00 |
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a2155a4ae6
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T-matrix with KS starting point
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2021-02-15 22:00:19 +01:00 |
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0f28af6d50
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Vxc in GW
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2021-02-15 17:27:06 +01:00 |
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e793ceaeca
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BCCD start
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2021-01-05 15:51:52 +01:00 |
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e0a28f71bd
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print qsUGW
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2020-12-10 09:19:58 +01:00 |
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fedc3a5d23
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removing GM correlation energy in qsGW
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2020-11-04 15:25:53 +01:00 |
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64f02d427a
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debug GM correlation energy
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2020-11-04 14:49:45 +01:00 |
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