vibronic couplings

Calculation of vibronic couplings for phenoxyl/phenol and benzyl/toluene self-exchange reactions: Implications for proton-coupled electron transfer mechanisms

90. J. H. Skone, A. V. Soudackov, and S. Hammes-Schiffer, “Calculation of vibronic couplings for phenoxyl/phenol and benzyl/toluene self-exchange reactions: Implications for proton-coupled electron transfer mechanisms,” J. Am. Chem. Soc. 128, 16655-16663 (2006).