PTEROSOR/QuAcK
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mirror of https://github.com/pfloos/quack synced 2025-05-07 07:35:02 +02:00
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3 Commits

Author SHA1 Message Date
Loris Burth
f4fd58f521 Added CAP integral for aug-cc-pvtz+3s3p3d on N2X 2025-03-27 15:47:55 +01:00
pfloos
42565f95f1 implement 1RDM and 2RDM for pCCD 2024-08-16 19:05:11 +02:00
Pierre-Francois Loos
7e633ed6da CAP integrals 2024-04-22 15:35:15 +02:00