Analytical potential energy surface for the GeH4+H→GeH3+H2 reaction: Thermal and vibrational-state selected rate constants and kinetic isotope effects
Author:
Publisher
AIP Publishing
Subject
Physical and Theoretical Chemistry,General Physics and Astronomy
Link
http://aip.scitation.org/doi/pdf/10.1063/1.479845
Reference34 articles.
1. Theoretical study of the CH4+F→CH3+FH reaction. II. Semiempirical surfaces
2. Analytical potential energy surface for the CH4+Cl→CH3+ClH reaction: Application of the variational transition state theory and analysis of the kinetic isotope effects
3. Recalibration of Two Earlier Potential Energy Surfaces for the CH4 + H → CH3 + H2 Reaction. Application of Variational Transition-State Theory and Analysis of the Kinetic Isotope Effects Using Rectilinear and Curvilinear Coordinates
4. Analytical potential energy surface for the NH3+H↔NH2+H2 reaction: Application of variational transition-state theory and analysis of the equilibrium constants and kinetic isotope effects using curvilinear and rectilinear coordinates
5. Analytical Surface for the Reaction with No Saddle-Point NH3 + F → NH2 + FH. Application of Variational Transition State Theory
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1. Variational transition state theory: theoretical framework and recent developments;Chemical Society Reviews;2017
2. Constructing Potential Energy Surfaces for Polyatomic Systems: Recent Progress and New Problems;Advances in Physical Chemistry;2012-10-09
3. Analytical potential energy surface for the reaction with intermediate complexes NH3 + Cl → NH2 + HCl: Application to the kinetics study;International Journal of Quantum Chemistry;2011-06-20
4. Computational Chemistry of Polyatomic Reaction Kinetics and Dynamics: The Quest for an Accurate CH5 Potential Energy Surface;Chemical Reviews;2007-10-31
5. Potential Energy Surface for Asymmetrically Substituted Reactions of Type CWXYZ + A. Kinetics Study;The Journal of Physical Chemistry A;2007-05-19
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