Anthony Scemama 36fda1d1bb Fix density matrices in SR correction

2023-11-10 14:23:26 +01:00

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amplitudes

Added entropy

2020-12-23 00:29:55 +01:00

cassd

Modernization

2021-12-17 19:28:01 +01:00

champ

Fixed #1

2022-04-11 23:03:50 +02:00

mp2

Added export_integrals

2020-03-23 17:34:43 +01:00

qmcchem

Fix density matrices in SR correction

2023-11-10 14:23:26 +01:00

utilities

Update for TREXIOv2

2021-12-07 19:30:23 +01:00

.gitignore

champ module

2019-01-23 17:42:42 +01:00