Reaction pathways in the solid state and the Hubbard U correction
Author:
Affiliation:
1. School of Environmental and Life Sciences, The University of Newcastle, Callaghan, NSW 2308, Australia
Funder
Australian Research Council
Publisher
AIP Publishing
Subject
Physical and Theoretical Chemistry,General Physics and Astronomy
Link
https://aip.scitation.org/doi/pdf/10.1063/5.0045526
Reference69 articles.
1. Density functional theory in the solid state
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4. SBH10: A Benchmark Database of Barrier Heights on Transition Metal Surfaces
5. A density functional study of the simplest hydrogen abstraction reaction. Effect of self-interaction correction
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