Benchmark Results for Hydrogen Atom Transfer Between Carbon Centers and Validation of Electronic Structure
03.02.2016
“Benchmark Results for Hydrogen Atom Transfer Between Carbon Centers and Validation of Electronic Structure Methods for Bond Energies and Barrier Heights” A. Dybała-Defratyka, P. Paneth, J. Pu, D.G. Truhlar J. Phys. Chem. A 108, 2475-86 (2004)