Year: 2014
Author: Lifei Wang, Feng Xu, Yujun Zheng
Journal of Atomic and Molecular Sciences, Vol. 5 (2014), Iss. 1 : pp. 21–25
Abstract
The recently formulated entangled trajectory molecular dynamics (ETMD) theory is applied to the collinear hydrogen exchange reaction. The reaction probability is calculated for one- and two-dimensional of collinear $H+H_2$ model. It is found that although the results of ETMD are not in good agreement with quantum mechanics simulations, the numerical trend is consistent with each other.
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Journal Article Details
Publisher Name: Global Science Press
Language: English
DOI: https://doi.org/10.4208/jams.050213.070413a
Journal of Atomic and Molecular Sciences, Vol. 5 (2014), Iss. 1 : pp. 21–25
Published online: 2014-01
AMS Subject Headings: Global Science Press
Copyright: COPYRIGHT: © Global Science Press
Pages: 5
Keywords: quantum phase space Wigner function entangled trajectory molecular dynamics.