Effects of variations in reaction coordinate eigenvalue on heavy‐atom kinetic isotope effects: Comparison of two methods for curving the potential barrier
Author:
Publisher
AIP Publishing
Subject
Physical and Theoretical Chemistry,General Physics and Astronomy
Link
http://aip.scitation.org/doi/pdf/10.1063/1.1681082
Reference26 articles.
1. On the Absence of Isotope Effects in the Absence of Force Constant Changes
2. Simplified Procedure for the Theoretical Calculation of Isotope Effects Involving Large Molecules
3. Isotope Effect in the Rupture of Carbon‐Carbon Bonds in Propane−1‐C13
4. Carbon Isotope Effect during Oxidation of Carbon Monoxide with Nitrogen Dioxide
5. Variations of heavy-atom kinetic isotope effects in SN2 displacement reactions
Cited by 4 articles. 订阅此论文施引文献 订阅此论文施引文献,注册后可以免费订阅5篇论文的施引文献,订阅后可以查看论文全部施引文献
1. 13C kinetic isotope effects and reaction coordinate motions in transition states for SN2 displacement reactions;Canadian Journal of Chemistry;1976-04-01
2. Isotope Effects in Chemical Kinetics;Annual Review of Physical Chemistry;1975-10
3. Calculation of heavy‐atom kinetic isotope effects: Application of the high temperature approximation to models with three‐element reaction coordinates;The Journal of Chemical Physics;1975-03-15
4. Calculation of heavy‐atom kinetic isotope effects: Barrier curvature and internal coordinate effects with three‐element reaction coordinates;The Journal of Chemical Physics;1974-05
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