Dual transformation for wave packet dynamics: Application to Coulomb systems.

Autor: Kawata, Isao, Kono, Hirohiko
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Zdroj: Journal of Chemical Physics; 12/1/1999, Vol. 111 Issue 21, p9498, 11p, 12 Graphs
Abstrakt: Describes a dual transformation technique that can deal with awkward Coulomb potentials, developed for electronic wave packet dynamics. Time evolution with the alternating-direction implicit method; Explicit forms for variable transformation; Phase space analysis in terms of a quasi-potential.
Databáze: Complementary Index