ISSN:
1089-7690
Source:
AIP Digital Archive
Topics:
Physics
,
Chemistry and Pharmacology
Notes:
A multiconfiguration self-consistent reaction field method is presented for calculating isotropic hyperfine coupling constants of solvated molecules. The solvent model is based on generalizations of Kirkwood's model for describing solvation effects. Isotropic hyperfine coupling constants are calculated for the methyl and ClO2 radicals in different solvents. © 1996 American Institute of Physics.
Type of Medium:
Electronic Resource
URL:
http://dx.doi.org/10.1063/1.470858