14 Commits

Author	SHA1	Message	Date
Anthony Scemama	dc50c99b43	Introduced reference PT2 energy	2019-03-22 18:16:41 +01:00
Anthony Scemama	3874dd1d95	Moved 4-idx into FourIndex.mli	2019-03-21 00:44:10 +01:00
Anthony Scemama	e250864a19	Minor changes	2019-01-15 15:18:01 +01:00
Anthony Scemama	4f41af9e31	Four-idx transformation	2018-07-20 16:10:20 +02:00
Anthony Scemama	955f9d014b	Added tests for AOBasis	2018-07-05 00:39:44 +02:00
Anthony Scemama	871cb2b6d8	Accelerated SCF	2018-07-04 18:42:26 +02:00
Anthony Scemama	26bcd62db4	Added small_core function	2018-07-04 18:08:38 +02:00
Anthony Scemama	f94a5ac268	Nuclei for T2	2018-06-29 16:04:40 +02:00
Anthony Scemama	8ded68a447	Added stream in Four_idx	2018-06-28 14:43:24 +02:00
Anthony Scemama	e4a3e1da97	Fixed overflow in Boys function	2018-06-27 13:13:59 +02:00
Anthony Scemama	63f0b379de	Accelerated FourIdxStorage	2018-06-01 10:26:22 +02:00
Anthony Scemama	15390759f9	Accelerated RHF	2018-05-31 18:50:34 +02:00
Anthony Scemama	f4f31db614	Changed integral storage to Float32	2018-03-27 19:32:37 +02:00
Anthony Scemama	ab7abda328	Cleaning in ERI	2018-03-27 16:31:44 +02:00