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866ed94153
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add S2
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2023-07-27 11:38:56 +02:00 |
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d738e335ba
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clean up
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2023-07-27 11:38:38 +02:00 |
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0a212628c3
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fix memory leaks in ppBSE
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2023-07-27 10:11:35 +02:00 |
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91c6e7db40
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ppBSE2@GF2
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2023-07-25 10:46:56 +02:00 |
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412e49f643
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fix bug in ppBSE@GW
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2023-07-24 22:40:00 +02:00 |
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2ecc80a278
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dynamic ppBSE@GW
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2023-07-24 22:34:52 +02:00 |
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b53f18fa79
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ppBSE dynamic kernel B and D
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2023-07-24 21:46:03 +02:00 |
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c0da089370
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ppBSE dynamic kernel B and D
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2023-07-24 21:45:51 +02:00 |
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d601d16dc5
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ppBSE dynamic kernel C
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2023-07-24 15:21:21 +02:00 |
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f0dda32d67
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ppBSE kernel
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2023-07-24 15:01:54 +02:00 |
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991e975f86
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ppBSE@GF2 static kernels
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2023-07-24 13:57:56 +02:00 |
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2aa079ceb0
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ppBSE@GF2 B block
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2023-07-24 13:38:18 +02:00 |
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4bb6dd20c5
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ppBSE@GF2 C and D blocks
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2023-07-24 13:02:24 +02:00 |
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bd6fdf87f1
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remove ERI_AO in GW GT
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2023-07-23 23:10:57 +02:00 |
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53ac297aa0
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rename n_diis in max_diis in read_options
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2023-07-23 22:05:38 +02:00 |
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4de7d1882d
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fix bug in HF diis
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2023-07-23 22:03:42 +02:00 |
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eb59072a2c
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cleanup
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2023-07-23 18:03:15 +02:00 |
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f515261c88
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GT and GW modules
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2023-07-23 17:41:44 +02:00 |
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aa1d3c90bc
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module GF
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2023-07-23 11:58:18 +02:00 |
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ed08450661
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RPA module
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2023-07-23 11:16:42 +02:00 |
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d91f343713
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fix bug in CI module
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2023-07-23 10:40:39 +02:00 |
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f5f34d9668
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CI module
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2023-07-23 10:29:24 +02:00 |
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75f4839725
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create CC module
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2023-07-22 22:19:46 +02:00 |
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b5ccfb734a
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remove Vxc and SigX and rename routines in UGT
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2023-07-22 21:40:19 +02:00 |
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1ea1d49a4e
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rename UGF routines
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2023-07-22 21:02:59 +02:00 |
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3a18f3e28a
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rename UAC routines
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2023-07-22 19:41:45 +02:00 |
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09e04f3f53
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bug in qsGW
|
2023-07-22 11:49:06 +02:00 |
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b010c872fc
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remove COHSEX completely
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2023-07-21 22:54:53 +02:00 |
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34fb993302
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clean up GTeh
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2023-07-21 20:38:49 +02:00 |
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c476b258ff
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rename ULR routines
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2023-07-21 13:04:29 +02:00 |
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5660146de5
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clean up GW and GT
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2023-07-21 12:30:29 +02:00 |
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1d9725546d
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fix bug in ppBSE
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2023-07-21 12:00:08 +02:00 |
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d11bebafe1
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fix bug in non-TDA dBSE@GW
|
2023-07-21 11:28:12 +02:00 |
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6cc9802d00
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include B term in phBSE2@GW
|
2023-07-21 11:18:00 +02:00 |
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d7e059c330
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remove useless routines in dBSE@GW
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2023-07-21 10:47:36 +02:00 |
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d8678bfe4f
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fix bug in dBSE@GW
|
2023-07-21 10:45:10 +02:00 |
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6c4d0c7544
|
Merge branch 'master' of github.com:pfloos/QuAcK
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2023-07-21 10:22:00 +02:00 |
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46ab457dc2
|
remove evDyn and cleanup dBSE@GW
|
2023-07-21 10:21:54 +02:00 |
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d310754ed1
|
Update README.md
|
2023-07-20 22:19:17 +02:00 |
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b53a1505be
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remove useless routines in utils
|
2023-07-20 22:17:47 +02:00 |
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e6d68ea534
|
remove static_screening
|
2023-07-20 22:09:12 +02:00 |
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752edf29bf
|
cleanup LR
|
2023-07-20 22:01:11 +02:00 |
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6df119aaba
|
move exchange
|
2023-07-20 21:54:31 +02:00 |
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4e7cb25352
|
move exchange
|
2023-07-20 21:54:09 +02:00 |
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5f0fad74d4
|
remove QP_roots
|
2023-07-20 21:51:58 +02:00 |
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600eb557b2
|
remove plot_GW
|
2023-07-20 21:50:41 +02:00 |
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3103f786d6
|
fix bug
|
2023-07-20 16:03:09 +02:00 |
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7d0541778b
|
rename kernel routines
|
2023-07-20 15:54:24 +02:00 |
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63ab549f6b
|
ppLR in GTpp and GW
|
2023-07-20 14:59:02 +02:00 |
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ad174054bb
|
Merge branch 'master' of github.com:pfloos/QuAcK
|
2023-07-20 12:38:02 +02:00 |
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