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M. Hellmann

1 paper hereh-index 15 citations9 works total

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  • physics.chem-ph1

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physics.chem-ph2026

The Direct-Product Decomposition Approach for Symmetry Exploitation in Many-Body Methods in Case of Non-Abelian Point Groups

Malte Hellmann, Jürgen Gauss

We demonstrate for the specific case of C3v​ how the direct-product decomposition scheme for the treatment of symmetry in coupled-cluster (CC) calculations can be extended to n…

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