Journal
REVIEWS OF MODERN PHYSICS
Volume 79, Issue 1, Pages 291-352Publisher
AMER PHYSICAL SOC
DOI: 10.1103/RevModPhys.79.291
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Today, coupled-cluster theory offers the most accurate results among the practical ab initio electronic-structure theories applicable to moderate-sized molecules. Though it was originally proposed for problems in physics, it has seen its greatest development in chemistry, enabling an extensive range of applications to molecular structure, excited states, properties, and all kinds of spectroscopy. In this review, the essential aspects of the theory are explained and illustrated with informative numerical results.
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