Validating and Analyzing EPR Hyperfine Coupling Constants with Density Functional Theory
J Chem Theory Comput
.
2013 May 14;9(5):2380-8.
doi: 10.1021/ct400171c.
Epub 2013 May 2.
Authors
Erik D Hedegård
1
,
Jacob Kongsted
1
,
Stephan P A Sauer
2
Affiliations
1
Department of Physics, Chemistry and Pharmacy, University of Southern Denmark.
2
Department of Chemistry, University of University, Copenhagen.
PMID:
26583728
DOI:
10.1021/ct400171c
No abstract available