Article ID Journal Published Year Pages File Type
5389771 Chemical Physics Letters 2006 5 Pages PDF
Abstract
The combination of correlation consistent basis sets and high level correlation treatment, such as provided by coupled cluster theory through single and double excitations with a quasi-perturbative treatment of triples, yields uniformly small errors with respect to experiment using statistics based on almost 300 molecules.
Related Topics
Physical Sciences and Engineering Chemistry Physical and Theoretical Chemistry
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