Role of the Solvent in Computing the 1,4-Benzosemiquinone g-Tensor by the Coupled-Perturbed Kohn−Sham Hybrid Density Functional Method
Author:
Affiliation:
1. Department of Chemistry, University of New Brunswick, Fredericton, New Brunswick, Canada E3B6E2
Publisher
American Chemical Society (ACS)
Subject
Materials Chemistry,Surfaces, Coatings and Films,Physical and Theoretical Chemistry
Link
https://pubs.acs.org/doi/pdf/10.1021/jp031230d
Reference44 articles.
1. Electron Spin Resonance of Semiquinones in Aprotic Solvents
2. Solvent Effects in Electron Spin Resonance Spectra
3. Validation of self‐consistent hybrid density functionals for the study of structural and electronic characteristics of organic π radicals
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