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Calculations on Collinear Reactions Using Hyperspherical Coordinates

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The Theory of Chemical Reaction Dynamics

Part of the book series: NATO ASI Series ((ASIC,volume 170))

Abstract

A number of new effects in reaction dynamics discovered by theoretical investigations using hyperspherical coordinates, e.g.

vibrational adiabaticity oscillating reactivity resonances and their mode specific decay vibrational bonding

are presented and discussed with respect to their experimental consequences. Finally it is shown that the important class of organic SN2-reactions may be investigated in an approximate collinear treatment using a combination of molecular structure and reaction dynamics theory.

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  1. Lehrstuhl für Theoretische Chemie, Universität Bonn, Wegelerstraβe 12, D-5300, Bonn 1, Germany

    J. Römelt

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  1. University Chemical Laboratory, University of Cambridge, UK

    D. C. Clary

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Römelt, J. (1986). Calculations on Collinear Reactions Using Hyperspherical Coordinates. In: Clary, D.C. (eds) The Theory of Chemical Reaction Dynamics. NATO ASI Series, vol 170. Springer, Dordrecht. https://doi.org/10.1007/978-94-009-4618-7_4

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  • DOI: https://doi.org/10.1007/978-94-009-4618-7_4

  • Publisher Name: Springer, Dordrecht

  • Print ISBN: 978-94-010-8552-6

  • Online ISBN: 978-94-009-4618-7

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