Ab initio calculations relevant to the m
β
Rosanna Bonaccorsi; Jocopo Tomasi; Christopher A. Reynolds; C. Thomson
π
Article
π
1988
π
John Wiley and Sons
π
English
β 427 KB
π 1 views
A number of important reactions involved in the formation and metabolism of N-nitrosamines have been studied using a modified reaction field method which treats the solute quantum mechanically and the solvent as a polarized dielectric.