The importance of exact exchange—A methodological investigation of NO reduction in heme–copper oxidases
Author:
Affiliation:
1. Department of Organic Chemistry, Arrhenius Laboratory, Stockholm University, SE-106 91 Stockholm, Sweden
Funder
Vetenskapsrådet
Publisher
AIP Publishing
Subject
Physical and Theoretical Chemistry,General Physics and Astronomy
Link
http://aip.scitation.org/doi/pdf/10.1063/5.0035634
Reference56 articles.
1. Quantum Chemical Studies of Mechanisms for Metalloenzymes
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5. Reparameterization of hybrid functionals based on energy differences of states of different multiplicity
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