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Published in 2017 at "Journal of Chemical Physics"
DOI: 10.1063/1.4983065
Abstract: Projected Hartree-Fock theory provides an accurate description of many kinds of strong correlations but does not properly describe weakly correlated systems. Coupled cluster theory, in contrast, does the opposite. It therefore seems natural to combine…
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Keywords:
projected hartree;
theory;
coupled cluster;
cluster theory ... See more keywords