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Reactive Scattering of Polyatomic Molecules
作者:
David C. Clary
DOI:
10.1002/0470845015.CRA006
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参考文章
(68)
1.
Wei-Ping Hu, Donald G. Truhlar,
Deuterium Kinetic Isotope Effects and Their Temperature Dependence in the Gas-Phase SN2 Reactions X- + CH3Y .fwdarw. CH3X + Y- (X, Y = Cl, Br, I)
Journal of the American Chemical Society.
,vol. 117, pp. 10726- 10734 ,(1995) ,
10.1021/JA00148A015
2.
Susan C. Tucker, Donald G. Truhlar,
A six-body potential energy surface for the SN2 reaction Cl-(g) + CH3Cl(g) and a variational transition-state-theory calculation of the rate constant
Journal of the American Chemical Society.
,vol. 112, pp. 3338- 3347 ,(1990) ,
10.1021/JA00165A013
3.
I. R. Sims, I. W. M. Smith, D. C. Clary, P. Bocherel, B. R. Rowe,
Ultra‐low temperature kinetics of neutral–neutral reactions: New experimental and theoretical results for OH+HBr between 295 and 23 K
Journal of Chemical Physics.
,vol. 101, pp. 1748- 1751 ,(1994) ,
10.1063/1.467733
4.
Michael J. Cohen, Andrew Willetts, Nicholas C. Handy,
Reaction rates of BrH+Cl→Br+HCl using semiclassical transition state theory
Chemical Physics Letters.
,vol. 223, pp. 459- 464 ,(1994) ,
10.1016/0009-2614(94)00475-7
5.
D. E. Manolopoulos, D. C. Clary,
Chapter 4. Quantum calculations on reactive collisions
Annual Reports Section "C" (Physical Chemistry).
,vol. 86, pp. 95- 118 ,(1989) ,
10.1039/PC9898600095
6.
Desheng Wang, Joel M. Bowman,
Quantum calculations of unusual mode specificity in H+C2H2→H2+C2H
The Journal of Chemical Physics.
,vol. 101, pp. 8646- 8662 ,(1994) ,
10.1063/1.468060
7.
Sergei K. Pogrebnya, Julian Echave, David C. Clary,
Quantum theory of four-atom reactions using arrangement channel hyperspherical coordinates: Formulation and application to OH+H2↔H2O+H
Journal of Chemical Physics.
,vol. 107, pp. 8975- 8984 ,(1997) ,
10.1063/1.475189
8.
Dong H. Zhang, John Z. H. Zhang,
Accurate quantum calculations for H2+OH→H2O+H: Reaction probabilities, cross sections, and rate constants
Journal of Chemical Physics.
,vol. 100, pp. 2697- 2706 ,(1994) ,
10.1063/1.466464
9.
David C. Clary,
Product CN Rotational Distributions from the H + HCN Reaction
The Journal of Physical Chemistry.
,vol. 99, pp. 13664- 13669 ,(1995) ,
10.1021/J100037A014
10.
Qiyan Sun, Joel M. Bowman,
Reduced dimensionality quantum reactive scattering: H2+CN→H+HCN
Journal of Chemical Physics.
,vol. 92, pp. 5201- 5210 ,(1990) ,
10.1063/1.458555
来源期刊
Encyclopedia of Computational Chemistry
John Wiley & Sons, Ltd
2002 年,
Volume: , Issue: ,
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