LCPQ/qp2
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1,780 Commits 30 Branches 18 Tags 80 MiB
5a0c8de5a3
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6 Commits

Author SHA1 Message Date
Anthony Scemama
5a0c8de5a3 Accelerated cholesky AO-MO transformation
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2023-07-05 19:12:03 +02:00
Anthony Scemama
4d9e28438c Improved I/O in CCSD
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2023-06-12 14:05:36 +02:00
Anthony Scemama
d2494ac323 Merge branch 'dev-stable' of github.com:quantumpackage/qp2 into dev-stable 
Conflicts:
	src/ao_two_e_ints/cholesky.irp.f
	src/mo_two_e_ints/cholesky.irp.f
 2023-05-26 11:49:51 +02:00
Anthony Scemama
f2ca86ef60 Improved cholesky 2023-05-26 11:48:08 +02:00
Anthony Scemama
a8948d0916 cholesky in big_array 2023-05-17 16:55:29 +02:00
Anthony Scemama
0330ac6ccc 4idx transformation with cholesky 2023-05-04 15:50:40 +02:00