Open-shell coupled-cluster valence-bond theory augmented with an independent amplitude approximation for three-pair correlations: Application to a model oxygen-evolving complex and single molecular magnet
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Title
Open-shell coupled-cluster valence-bond theory augmented with an independent amplitude approximation for three-pair correlations: Application to a model oxygen-evolving complex and single molecular magnet
Authors
Keywords
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Journal
JOURNAL OF CHEMICAL PHYSICS
Volume 149, Issue 24, Pages 244121
Publisher
AIP Publishing
Online
2018-12-31
DOI
10.1063/1.5052667
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