26 Commits

Author	SHA1	Message	Date
Anthony Scemama	6c275d54ef	Fix intent	2024-07-09 22:14:19 +02:00
Anthony Scemama	9ad69bb27d	GPU accelerated CCSD	2024-07-09 03:27:54 +02:00
Anthony Scemama	f09e91cb22	Working on CCSD GPU	2024-07-09 02:59:26 +02:00
Anthony Scemama	5b1e5f84e6	Working on r2	2024-07-04 14:52:09 +02:00
Anthony Scemama	a788426aa5	Working on r2	2024-07-04 12:01:16 +02:00
Anthony Scemama	7ceb8fdcca	Finished r1	2024-07-03 18:24:13 +02:00
Anthony Scemama	92fe3a6f84	Working on r1	2024-07-02 18:36:19 +02:00
Anthony Scemama	447cdcd907	Working on r1	2024-07-02 17:22:41 +02:00
Anthony Scemama	2bead959d0	Fxied GPU interface for gfortran	2024-07-02 13:58:19 +02:00
Anthony Scemama	44a7729f65	H_ finished in CCSD	2024-07-01 19:00:27 +02:00
Anthony Scemama	d3c1994c64	H_vv	2024-07-01 18:04:48 +02:00
Anthony Scemama	860121d404	H_oo on GPU	2024-06-29 02:59:51 +02:00
Anthony Scemama	fa6d141949	Introducing GPU in CCSD	2024-06-27 15:45:52 +02:00
Anthony Scemama	e2416a2d68	Fix openMP compilation in CCSD	2023-08-21 10:05:48 +02:00
Anthony Scemama	2201733dbe	Merge branch 'dev-stable' of https://github.com/QuantumPackage/qp2 into dev-stable	2023-08-21 09:56:09 +02:00
Anthony Scemama	a4d7648bb0	Fix segfault in cholesky due to array syntax	2023-08-21 09:56:07 +02:00
Anthony Scemama	467f756379	Optimized A1 in CCSD	2023-07-16 20:04:17 +02:00
Anthony Scemama	4ad7765127	Minor changes	2023-07-12 18:56:13 +02:00
Anthony Scemama	fba2fefb19	Moved loop	2023-07-12 18:33:18 +02:00
Anthony Scemama	d4574f24d9	Reduced memory in CCSD	2023-07-12 12:34:48 +02:00
Anthony Scemama	8c65e01eed	I/O in Cholesky	2023-07-11 17:31:58 +02:00
Anthony Scemama	64ee4eab75	Removed all vvv in CCSD	2023-07-11 15:13:01 +02:00
Anthony Scemama	326dbe7740	Removed vvov	2023-07-10 23:32:43 +02:00
Anthony Scemama	44956060e7	Removed vvv arrays	2023-07-10 22:50:15 +02:00
Anthony Scemama	9ce6eb78c8	Cholesky in CCSD	2023-07-10 13:30:51 +02:00
Anthony Scemama	e82220a6a4	Working on Cholesky CCSD	2023-07-06 02:12:42 +02:00