Biofuel Combustion. Energetics and Kinetics of Hydrogen Abstraction from Carbon-1 in<i>n</i>-Butanol by the Hydroperoxyl Radical Calculated by Coupled Cluster and Density Functional Theories and Multistructural Variational Transition-State Theory with Multidimensional Tunneling
I. M. Alecu(University of Minnesota), Donald G. Truhlar(University of Minnesota System), Tao Yu(Dalian University of Technology), Jingjing Zheng(University of Science and Technology of China), Ewa Papajak(Ames Research Center)
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