Semi-empirical potential energy surfaces for the reactions H + HCl → H2 + Cl and H' + HCl → H' Cl + H
Author:
Publisher
Elsevier BV
Subject
Physical and Theoretical Chemistry,General Physics and Astronomy
Reference27 articles.
1. Potential energy surfaces for atom transfer reactions involving hydrogens and halogens
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4. Self-consistent-field potential energy surface in three dimensions for the Cl + H2 → ClH + H chemical reaction
5. PNO-CEPA calculation of collinear potential energy barriers for thermoneutral exchange reactions
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1. A Review of Quantum-Mechanical Approximate Treatments of Three-Body Reactive Systems;Advances in Chemical Physics;2007-03-14
2. Quantum scattering calculation for reaction Br + H2 on two potential energy surfaces;International Journal of Quantum Chemistry;2006
3. An Improved Potential Energy Surface for the H2Cl System and Its Use for Calculations of Rate Coefficients and Kinetic Isotope Effects;The Journal of Physical Chemistry;1996-01-01
4. A New Potential Energy Surface for H2Br and Its Use To Calculate Branching Ratios and Kinetic Isotope Effects for the H + HBr Reaction;The Journal of Physical Chemistry;1995-01
5. Kinetic isotope studies of the gas-phase reaction (H,D,Mu)+HBr→(H,D,Mu)H+Br;Hyperfine Interactions;1994-12
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