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Coherent and dissipative wave packet dynamics in cyclic model systems with four equivalent potential minima.

Authors :
Brackhagen, O.
Kühn, O.
Manz, J.
May, V.
Meyer, R.
Source :
Journal of Chemical Physics. 6/15/1994, Vol. 100 Issue 12, p9007. 11p.
Publication Year :
1994

Abstract

The dynamics of cyclic systems with four equivalent potential minima is studied here from two different points of view. The solution of the time-dependent Schrödinger equation provides insight into the coherent wave packet motion. The resulting reaction mechanism involves relocalization between opposite, not neighboring potential minima. The inclusion of an environment within a density matrix description leads to dissipation and therefore to a transition from coherent to incoherent dynamics. The theoretical considerations are applied to a simple model of the cyclic motion of a proton in a molecular framework. [ABSTRACT FROM AUTHOR]

Details

Language :
English
ISSN :
00219606
Volume :
100
Issue :
12
Database :
Academic Search Index
Journal :
Journal of Chemical Physics
Publication Type :
Academic Journal
Accession number :
7641787
Full Text :
https://doi.org/10.1063/1.466705