LCPQ/quantum_package
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1,949 Commits 6 Branches 5 Tags 93 MiB
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4 Commits

Author SHA1 Message Date
Anthony Scemama
cbdc8f68d7 Corrected diagonalize_CI 2016-09-30 15:12:17 +02:00
Anthony Scemama
20a857c446 Distributed PT2 2016-02-19 00:20:28 +01:00
Anthony Scemama
e85a5927a1 Natural orbitals using SVD 2015-12-08 13:24:43 +01:00
Anthony Scemama
8ca2815964 Added CAS+S 2015-11-25 11:49:42 +01:00