Journal article
Computational modeling of isotropic electron paramagnetic resonance spectra of doublet state main group radicals
Abstract
The combined use of theoretical and mathematical methods in the analysis of electron paramagnetic resonance data has greatly increased the ability to interpret even the most complex spectra reported for doublet state inorganic main group radicals. This personal account summarizes the theoretical basis of such an approach and provides an in-depth discussion of some recent illustrative examples of the utilization of this methodology in practical …
Authors
Tuononen HM; Chivers T; Armstrong A; Fedorchuk C; Boeré RT
Journal
Journal of Organometallic Chemistry, Vol. 692, No. 13, pp. 2705–2715
Publisher
Elsevier
Publication Date
June 2007
DOI
10.1016/j.jorganchem.2006.12.019
ISSN
0022-328X