Evaluation of DFT methods to study reactions of benzene with OH radical

Aspects of the Atmospheric Chemistry of Amides

(2010) Ian Barnes et al.   CHEMPHYSCHEM

Tropospheric Aqueous-Phase Free-Radical Chemistry: Radical Sources, Spectra, Reaction Kinetics and Prediction Tools

(2010) Hartmut Herrmann et al.   CHEMPHYSCHEM

Atmospheric Oxidation of Trichloroethylene: An Ab Initio Study

(2010) Carrie J. Christiansen et al.   JOURNAL OF PHYSICAL CHEMISTRY A

Analysis of the Reactivities of Protein C−H Bonds to H Atom Abstraction by OH Radical

(2010) Steve Scheiner et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

How Solvent Modulates Hydroxyl Radical Reactivity in Hydrogen Atom Abstractions

(2010) Susan Mitroka et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

The benzene+OH potential energy surface: intermediates and transition states

(2010) David S. Hollman et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Interaction and Reaction of the Phenyl Radical with Water: A Source of OH Radicals

(2009) Artur Mardyukov et al.   ANGEWANDTE CHEMIE-INTERNATIONAL EDITION

Theoretical studies on the kinetics and thermochemistry of the gas-phase addition and H-abstraction reactions of 4-picoline with OH radical

(2009) Kh. Jogeshwari Devi et al.   CHEMICAL PHYSICS LETTERS

Organic Radical Reactions Associated with Nitrogen Monoxide

(2009) Jens Hartung   CHEMICAL REVIEWS

DFT study of the reaction of quercetin with and radicals

(2009) Z. Dhaouadi et al.   JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM

Hydrogen abstraction from biphenyl, acenaphthylene, naphthalene and phenanthrene by atomic hydrogen and methyl radical: DFT and G3(MP2)-RAD data

(2009) Yannick Carissan et al.   JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM

Kinetic Study of the 2-Naphthyl (C10H7) Radical Reaction with C2H2

(2009) J. Park et al.   JOURNAL OF PHYSICAL CHEMISTRY A

Decomposition of Methylbenzyl Radicals in the Pyrolysis and Oxidation of Xylenes

(2009) Gabriel da Silva et al.   JOURNAL OF PHYSICAL CHEMISTRY A

Ab Initio Chemical Kinetic Study for Reactions of H Atoms with SiH4and Si2H6: Comparison of Theory and Experiment

(2009) S. Y. Wu et al.   JOURNAL OF PHYSICAL CHEMISTRY A

Evidence for Conformational Movement and Radical Mechanism in the Reaction of 4-Thia-l-lysine with Lysine 5,6-Aminomutase

(2009) Amarendra N. Maity et al.   JOURNAL OF PHYSICAL CHEMISTRY B

Peculiar Stability of Amino Acids and Peptides from a Radical Perspective

(2009) Zachary I. Watts et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Theoretical Explanation of Nonexponential OH Decay in Reactions with Benzene and Toluene under Pseudo-First-Order Conditions

(2008) Víctor Hugo Uc et al.   JOURNAL OF PHYSICAL CHEMISTRY A