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- W2134411338 abstract "The basic aspects of coupled cluster (CC) theories are reviewed from the perspective of its applicability to molecular systems with strong many-body correlation effects. In practice strong correlation refers to systems where the corresponding wavefunctions are characterized by multiconfigurational character corresponding to collective excitations from the reference function/functions. Several CC formalisms specifically designed to tackle these situations are discussed. These include single reference CC methodologies accounting for high-rank excitations and multireference CC approaches. Special attention is paid to non-iterative methods, which provide a widely accepted compromise between accuracy and numerical cost. We also discuss major theoretical and computational challenges which have to be addressed for the future developments of CC methodologies." @default.
- W2134411338 created "2016-06-24" @default.
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- W2134411338 creator A5029056296 @default.
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- W2134411338 date "2013-01-01" @default.
- W2134411338 modified "2023-10-10" @default.
- W2134411338 title "Coupled Cluster Theories for Strongly Correlated Molecular Systems" @default.
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