Published January 24, 2011 | Version v1
Journal article

Isotopic effects on the stereodynamics for the Ne+H2+/Ne+HD+/Ne+HT+ reactions

  • 1. School of Physics, Ludong University, Yantai 264025 (China)

Description

Graphical abstract: The isotopic effects on Ne+H2+/Ne+HD+/Ne+HT+ reactions are presented by stereodynamics calculations with quasi-classical trajectory method. Research highlights: → The isotopic effects on Ne+H2+/HD+/HT+ reactions are shown by stereodynamics. → The product rotational angular momentum vector are both aligned and oriented. → The isotopic effect on PDDCS is different to different products but same reactant. - Abstract: Isotopic effects on the stereodynamic properties of Ne+H2+/Ne+HD+/Ne+HT+ reactions are investigated using a quasi-classical trajectory method at a collision energy of 0.7 eV on a new surface constructed by Lv et al. (S.J. Lv, P.Y. Zhang, K.L. Han, G.Z. He, J. Chem. Phys. 132 (2010) 014303). The polarization-dependent generalized differential cross sections and alignments of the product rotational angular momentum for all reactions are reported. Remarkable isotopic effects in all reactions are observed. The relationship between the isotopic effect and the mass factor of the reactant atoms is also examined.

Availability note (English)

Available from http://dx.doi.org/10.1016/j.chemphys.2010.11.002

Additional details

Identifiers

DOI
10.1016/j.chemphys.2010.11.002;
PII
S0301-0104(10)00497-0;

Publishing Information

Journal Title
Chemical Physics
Journal Volume
379
Journal Issue
1-3
Journal Page Range
p. 46-50
ISSN
0301-0104
CODEN
CMPHC2

Optional Information

Copyright
Copyright (c) 2010 Elsevier Science B.V., Amsterdam, The Netherlands, All rights reserved.