LCPQ/qp2
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mirror of https://github.com/QuantumPackage/qp2.git synced 2024-12-22 11:33:29 +01:00
Code Releases Activity
1,510 Commits 30 Branches 18 Tags 80 MiB
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10 Commits

Author SHA1 Message Date
eginer
bcaca2bab1 Merge branch 'dev-stable-tc-scf' of https://github.com/QuantumPackage/qp2 into dev-stable-tc-scf
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continuous-integration/drone/push Build was killed
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2023-03-29 15:48:11 +02:00
eginer
6d7d7ccfb4 set the threshold_cycle to 1e-10 by default 2023-03-29 15:47:59 +02:00
Anthony Scemama
405614c400 Merge branch 'dev-stable-tc-scf' of github.com:QuantumPackage/qp2 into dev-stable-tc-scf 2023-03-28 13:18:22 +02:00
eginer
436b881580 added thresh_cycle 2023-03-28 11:21:19 +02:00
Anthony Scemama
e710d26237 Improve I/O on TC integrals 2023-03-17 19:23:07 +01:00
eginer
22fb8c17e2 fixed the bug of misalignement between coefs and determinants in fci_tc_bi_ortho 2023-03-16 14:00:21 +01:00
Abdallah Ammar
4a23b63a42 Merge branch 'dev-stable' into dev-stable-tc-scf 2023-03-04 14:33:43 +01:00
Abdallah Ammar
ec082f641b tc_keywords: combined 2023-03-04 02:24:16 +01:00
eginer
274e903d3c added spin density 2023-02-24 21:38:09 +01:00
eginer
4472a6d9be non_h_ints compiles 2023-02-06 19:00:35 +01:00