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Author	SHA1	Message	Date
pfloos	bf77863d6c	QP search for SRG done	2024-09-11 20:35:07 +02:00
pfloos	04a42701e2	working on SRG for GW	2024-09-11 18:41:27 +02:00
pfloos	6a7b0337d9	remove more SRG	2024-09-11 17:59:28 +02:00
pfloos	9f98f7b856	remove SRG-qsGW methods	2024-09-11 17:58:36 +02:00
pfloos	c2d92e2299	UGW_SRG	2024-09-11 17:21:43 +02:00
pfloos	da7bdcd809	fusion SRG into qsGW	2024-09-11 15:09:40 +02:00
pfloos	9ce21a9d2b	Merge branch 'master' of github.com:pfloos/QuAcK	2024-09-11 11:39:13 +02:00
pfloos	eb6f35a799	starting cleaning SRG	2024-09-11 11:39:03 +02:00
Abdallah Ammar	ab4cca296e	fixed openmp bug	2024-09-11 10:51:37 +02:00
Abdallah Ammar	b329da2d1c	Merge branch 'master' of https://github.com/pfloos/QuAcK	2024-09-11 10:43:29 +02:00
Abdallah Ammar	abc74b8ced	opt in RGW_excitation_density	2024-09-11 10:43:07 +02:00
pfloos	c1107474ff	more cleaning	2024-09-11 10:13:11 +02:00
Abdallah Ammar	f04ea269da	more optim in BSE (davidson) kernels	2024-09-11 09:51:07 +02:00
Abdallah Ammar	ee2fa09dda	optimized ppBSE kernels for Davidson: ispin = 2 + ERI access improv	2024-09-11 01:36:42 +02:00
Abdallah Ammar	0deffa8638	Merge branch 'master' of https://github.com/pfloos/QuAcK	2024-09-11 00:25:47 +02:00
Abdallah Ammar	13d9ce5eda	optimized ppBSE kernels for Davidson	2024-09-11 00:25:42 +02:00
Pierre-Francois Loos	34fba9ed9c	remove RMP3	2024-09-10 17:08:16 +02:00
Pierre-Francois Loos	66c59f85a1	remove unnecessary code in AOtoMO	2024-09-10 17:05:03 +02:00
Pierre-Francois Loos	ba54a465a7	Merge branch 'master' of github.com:pfloos/QuAcK	2024-09-10 16:44:05 +02:00
Pierre-Francois Loos	66dfcd6ae7	move orthogonalization matrix	2024-09-10 16:43:58 +02:00
Abdallah Ammar	4f24625c9d	Merge branch 'master' of https://github.com/pfloos/QuAcK	2024-09-10 16:27:52 +02:00
Abdallah Ammar	0d8601d0e2	Davidson refact + add BSEpp@GW kernels (naive version)	2024-09-10 16:27:49 +02:00
Pierre-Francois Loos	d55584295d	more cleanup (dity up)	2024-09-10 15:11:06 +02:00
Pierre-Francois Loos	e01b6bedd1	Merge branch 'master' of github.com:pfloos/QuAcK	2024-09-10 14:35:52 +02:00
Pierre-Francois Loos	055fd3712a	karlsruhe XBS version	2024-09-10 14:35:45 +02:00
Abdallah Ammar	33439ca350	Merge branch 'master' of https://github.com/pfloos/QuAcK	2024-09-10 10:13:55 +02:00
Abdallah Ammar	bb337206eb	refactoring in Davidson	2024-09-10 10:13:50 +02:00
Pierre-Francois Loos	826d80d594	more cleanup	2024-09-10 09:40:22 +02:00
Pierre-Francois Loos	65ba14706c	cleanup in RG0W0	2024-09-10 09:34:46 +02:00
pfloos	e2617c1113	debugging AC@BSE	2024-09-09 20:49:35 +02:00
pfloos	0cbd4fb10f	create G routines and remove duplicated code	2024-09-08 17:23:23 +02:00
pfloos	b6652240d3	GG0T0pp	2024-09-08 17:15:27 +02:00
pfloos	d5a396200e	remove redundant code	2024-09-08 16:19:03 +02:00
Abdallah Ammar	8c01e47080	reduce lines to <= 132 char	2024-09-08 16:11:34 +02:00
Abdallah Ammar	9e5c2c629f	rm olympe by default	2024-09-07 14:02:43 +02:00
Abdallah Ammar	3142c59066	Merge branch 'master' of https://github.com/pfloos/QuAcK	2024-09-07 13:59:20 +02:00
Abdallah Ammar	178cf40214	added Davidson for ppLR_RG0T0pp	2024-09-07 13:59:15 +02:00
pfloos	f85bd15e03	creating new routines gor G branch in RPA, LR, GF and GW	2024-09-06 22:14:51 +02:00
pfloos	27f14363c7	phGLR subroutines	2024-09-06 21:35:42 +02:00
Antoine Marie	b9da29a020	openmp in ppbse@gf2	2024-09-06 20:54:12 +02:00
Antoine Marie	4134aadac5	fixed ppBSE@GF2, still need to add openMP on loops	2024-09-06 20:40:54 +02:00
Pierre-Francois Loos	cd25d07f6f	ebugging GF2 ppBSE spin adaptation	2024-09-06 16:16:16 +02:00
Pierre-Francois Loos	c9a269cbb6	ppBSE@GF2@GHF	2024-09-06 15:54:24 +02:00
Antoine Marie	07a625d854	Merge branch 'master' of github.com:pfloos/QuAcK	2024-09-06 15:22:51 +02:00
Pierre-Francois Loos	fa69888f48	ppBSE@GW@GHF	2024-09-06 13:47:15 +02:00
Antoine Marie	95a7372e2f	rename BSE files in GF2	2024-09-06 11:50:43 +02:00
Antoine Marie	3111666d15	openMP implementation of the VV block for ppBSE@GF2	2024-09-06 11:26:47 +02:00
Pierre-Francois Loos	2fd6158722	small print again	2024-09-04 16:17:44 +02:00
Pierre-Francois Loos	4d022994c9	small print	2024-09-04 16:16:29 +02:00
Abdallah Ammar	4a6b95aac7	added local svd	2024-09-04 08:22:03 +02:00