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Molecular Physics
An International Journal at the Interface Between Chemistry and Physics
Volume 33, 1977 - Issue 3
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Original Articles

The importance of isotope-dependent transmission coefficients in calculating low-temperature isotope effects

Donald G. Truhlar Department of Chemistry, University of Minnesota, Minneapolis, Minnesota, 55455; Joint Institute for Laboratory Astrophysics, University of Colorado and National Bureau of Standards, Boulder, Colorado, 80309View further author information
,
Aron Kuppermann A. A. Noyes Laboratory of Chemical Physics, California Institute of Technology, Pasadena, California, 91125
&
John Dwyer A. A. Noyes Laboratory of Chemical Physics, California Institute of Technology, Pasadena, California, 91125
Pages 683-688 | Received 13 Feb 1976, Published online: 22 Aug 2006

Citations (7)

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W.A. Wassam$suffix/text()$suffix/text() & R.D. Levine. (1977) Comment on the isotope dependence of transmission coefficients. Molecular Physics 33:3, pages 689-697.
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Articles from other publishers (6)

Naomi Rom, Nimrod Moiseyev & Roland Lefebvre. (1992) Thermal rate constants in collinear atom transfer reactions by optimizing the position of the reactants/products dividing surface. The Journal of Chemical Physics 96:11, pages 8307-8313.
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D. K. Bondi, D. C. Clary, J. N. L. Connor, Bruce C. Garrett & Donald G. Truhlar. (1982) Kinetic isotope effects in the Mu+H2 and Mu+D2 reactions: Accurate quantum calculations for the collinear reactions and variational transition state theory predictions for one and three dimensions. The Journal of Chemical Physics 76:10, pages 4986-4995.
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Bruce C. Garrett, Donald G. Truhlar, Roger S. Grev, Alan W. Magnuson & J. N. L. Connor. (1980) Variational transition state theory, vibrationally adiabatic transmission coefficients, and the unified statistical model tested against accurate quantal rate constants for collinear F+H2, H+F2, and isotopic analogs. The Journal of Chemical Physics 73:4, pages 1721-1728.
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Bruce C. Garrett, Donald G. Truhlar, Roger S. Grev & Robert B. Walker. (1980) Comparison of variational transition state theory and the unified statistical model with vibrationally adiabatic transmission coefficients to accurate collinear rate constants for T+HD→TH+D. The Journal of Chemical Physics 73:1, pages 235-240.
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Bruce C. Garrett & Donald G. Truhlar. (1980) Generalized transition state theory calculations for the reactions D+H2 and H+D2 using an accurate potential energy surface: Explanation of the kinetic isotope effect. The Journal of Chemical Physics 72:6, pages 3460-3471.
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J.N.L. Connor. (1979) Reactive molecular collision calculations. Computer Physics Communications 17:1-2, pages 117-143.
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