The MOBH35 Metal–Organic Barrier Heights Reconsidered: Performance of Local-Orbital Coupled Cluster Approaches in Different Static Correlation Regimes
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Title
The MOBH35 Metal–Organic Barrier Heights Reconsidered: Performance of Local-Orbital Coupled Cluster Approaches in Different Static Correlation Regimes
Authors
Keywords
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Journal
Journal of Chemical Theory and Computation
Volume 18, Issue 2, Pages 883-898
Publisher
American Chemical Society (ACS)
Online
2022-01-20
DOI
10.1021/acs.jctc.1c01126
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