Hydrogen Abstraction Reactions from Phenolic Compounds by Peroxyl Radicals: Multireference Character and Density Functional Theory Rate Constants
Galano, Annia, Muñoz-Rugeles, Leonardo, Alvarez-Idaboy, Juan Raul, Bao, Junwei (Lucas), Truhlar, Donald G.Language:
english
Journal:
The Journal of Physical Chemistry A
DOI:
10.1021/acs.jpca.5b07662
Date:
September, 2015
File:
PDF, 1.53 MB
english, 2015