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Commit Graph

13 Commits

Author SHA1 Message Date
d4574f24d9 Reduced memory in CCSD 2023-07-12 12:34:48 +02:00
e35f847341 Enabled direct integrals in Cholesky 2023-07-06 17:51:59 +02:00
a2c4a74d92 Fixed writing MOs for large sizes'
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2023-07-06 17:13:48 +02:00
e82220a6a4 Working on Cholesky CCSD 2023-07-06 02:12:42 +02:00
41a369dd68 Optimized 4idx with Cholesky 2023-07-05 17:43:31 +02:00
a8948d0916 cholesky in big_array 2023-05-17 16:55:29 +02:00
0330ac6ccc 4idx transformation with cholesky 2023-05-04 15:50:40 +02:00
43704f8fc7 Accelerated 4idx transformation
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2023-02-16 18:34:47 +01:00
Emmanuel Giner
e7042e65c7 added old version of no_vvvv which works 2021-07-01 11:25:51 +02:00
329bcf805b Fixed schwartz screening when integrals are read 2020-05-12 22:48:37 +02:00
a744bc30d4 Fast 4-idx transformation 2019-07-05 23:54:08 +02:00
0336738109 Working on fast integrals 2019-07-05 18:50:22 +02:00
24d9745056 Initial commit 2019-01-25 11:39:31 +01:00