Quantum dynamics of H+LiH+ reaction on its electronic ground state

Roy, Tanmoy ; Rao, Rajagopala T. ; Mahapatra, S. (2011) Quantum dynamics of H+LiH+ reaction on its electronic ground state Chemical Physics Letters, 501 (4-6). pp. 252-256. ISSN 0009-2614

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Official URL: http://www.sciencedirect.com/science/article/pii/S...

Related URL: http://dx.doi.org/10.1016/j.cplett.2010.11.075

Abstract

State specific dynamics of the H + LiH+ reaction is theoretically investigated on its electronic ground potential energy surface employing a time-dependent wave packet approach. Channel specific integral reaction cross-sections and thermal rate constants are reported. Impact of the low-energy collision-induced dissociation channel on the reactive dynamics is discussed.

Item Type:Article
Source:Copyright of this article belongs to Elsevier Science.
ID Code:98662
Deposited On:17 Dec 2014 05:43
Last Modified:17 Dec 2014 05:43

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