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mirror of https://github.com/QuantumPackage/qp2.git synced 2024-07-06 11:15:49 +02:00
Commit Graph

6 Commits

Author SHA1 Message Date
Emmanuel Giner
919662ee0b beginning to rewrite two_rdm 2019-07-04 16:16:57 +02:00
Emmanuel Giner LCT
55286d7889 improvement in casscf with CISD, CISDTQ and so on 2019-07-04 00:40:02 +02:00
Emmanuel Giner LCT
39da8cad5b renamed two-rdm for explicit separation between all states and state average 2019-07-01 17:49:31 +02:00
Emmanuel Giner
57eabff675 added documentation for the two-rdm 2019-06-29 17:29:32 +02:00
Emmanuel Giner
78fe995f55 getting there with active orbitals 2019-06-28 20:45:07 +02:00
eginer
e9724fa8c7 beginning to work on general routine for 2rdm 2019-06-28 15:17:04 +02:00