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67abf13740
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RHF earch seems to work
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2023-11-04 12:02:38 +01:00 |
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3b958f5610
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HF solution search
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2023-11-03 19:48:12 +01:00 |
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Pierre-Francois Loos
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ffe8065339
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fix GM correlation energy in SRG
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2023-11-02 16:53:07 +01:00 |
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Pierre-Francois Loos
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4c9841c5cd
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evGGF2 and evGGW
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2023-10-27 13:56:53 +02:00 |
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c7093e0c2c
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BSE@GHF
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2023-10-26 23:28:53 +02:00 |
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5bf12265b5
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S^2 in GHF
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2023-10-26 22:07:55 +02:00 |
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9d28c496b9
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print GHF
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2023-10-26 21:32:34 +02:00 |
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Pierre-Francois Loos
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5b8c0d542c
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post-GHF methods
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2023-10-26 18:00:16 +02:00 |
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0b892dbe31
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restructuration QuAcK for restricted and unrestricted branches
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2023-10-25 21:38:20 +02:00 |
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4d8b25dfea
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add QP search in UG0W0 and evUGW
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2023-10-25 13:19:21 +02:00 |
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5d0441e850
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fix bug in qsUGW and evUGW
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2023-10-25 00:05:17 +02:00 |
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Pierre-Francois Loos
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1084fcebea
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fix bug... maybe
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2023-10-24 17:03:41 +02:00 |
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83e5c9b07c
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fix bug in UG0W0
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2023-10-23 21:36:07 +02:00 |
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76db32142b
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more clean up
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2023-09-07 22:28:47 +02:00 |
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c8c95ff439
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modify lin vs qp solutions
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2023-09-07 14:01:58 +02:00 |
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00049621ff
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fix bug in ROHF
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2023-09-06 09:50:29 +02:00 |
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99cbd0e95d
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ROHF not yet debugged
|
2023-09-05 17:23:40 +02:00 |
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7efca56054
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plotting routines
|
2023-08-24 00:02:23 +02:00 |
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b96f11ad2d
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fix bug in sc eh T-matrix modules
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2023-08-23 16:04:00 +02:00 |
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f631f1711b
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modify print in GTeh
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2023-08-22 22:30:11 +02:00 |
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9e65d4a090
|
cleaning prints and fix bug in regularization
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2023-08-01 21:32:57 +02:00 |
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0dfa3b0071
|
clean up in RPA
|
2023-07-31 16:01:12 +02:00 |
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29f3312cfc
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remove useless routines
|
2023-07-31 14:47:09 +02:00 |
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|
2d61eaa29f
|
clean up UGW
|
2023-07-30 22:01:44 +02:00 |
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6c4c526995
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cleanup QuAcK main module
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2023-07-29 09:24:55 +02:00 |
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68e6f02ae2
|
clean print excitations
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2023-07-28 14:35:14 +02:00 |
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6b56acf66b
|
updating Z in QP roots
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2023-07-27 21:23:40 +02:00 |
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4fec6e88f5
|
clean up GTpp
|
2023-07-27 19:17:20 +02:00 |
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|
ee0cb0fd6a
|
fix root search
|
2023-07-27 17:43:18 +02:00 |
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044058ac66
|
root search for GTeh
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2023-07-27 16:43:15 +02:00 |
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|
0a212628c3
|
fix memory leaks in ppBSE
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2023-07-27 10:11:35 +02:00 |
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91c6e7db40
|
ppBSE2@GF2
|
2023-07-25 10:46:56 +02:00 |
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09e04f3f53
|
bug in qsGW
|
2023-07-22 11:49:06 +02:00 |
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b010c872fc
|
remove COHSEX completely
|
2023-07-21 22:54:53 +02:00 |
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34fb993302
|
clean up GTeh
|
2023-07-21 20:38:49 +02:00 |
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5660146de5
|
clean up GW and GT
|
2023-07-21 12:30:29 +02:00 |
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1d9725546d
|
fix bug in ppBSE
|
2023-07-21 12:00:08 +02:00 |
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d11bebafe1
|
fix bug in non-TDA dBSE@GW
|
2023-07-21 11:28:12 +02:00 |
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6cc9802d00
|
include B term in phBSE2@GW
|
2023-07-21 11:18:00 +02:00 |
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d7e059c330
|
remove useless routines in dBSE@GW
|
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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46ab457dc2
|
remove evDyn and cleanup dBSE@GW
|
2023-07-21 10:21:54 +02:00 |
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3103f786d6
|
fix bug
|
2023-07-20 16:03:09 +02:00 |
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092a3f5e6d
|
OK with LR in RPA routines
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2023-07-18 11:53:38 +02:00 |
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266be65f2e
|
OK for ppLR
|
2023-07-18 09:59:25 +02:00 |
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2c7653b7bc
|
add HF module
|
2023-07-17 13:35:24 +02:00 |
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ae540679cd
|
more renaming
|
2023-07-12 23:16:37 +02:00 |
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d207fb5173
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renaming LR routines and fix bug in Z GW
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2023-07-12 13:34:10 +02:00 |
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06df6109fa
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add optimization in GT
|
2023-07-10 11:53:42 +02:00 |
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490dd13c0d
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remove SOSEX
|
2023-07-04 10:37:54 +02:00 |
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