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Journal article

Quantum dynamics via a time propagator in Wigner's phase space

From

Department of Chemistry (IK), Technical University of Denmark1

Physical Chemistry, Department of Chemistry, Technical University of Denmark2

Department of Chemistry, Technical University of Denmark3

We derive an expression for a short-time phase space propagator. We use it in a new propagation scheme and demonstrate that it works for a Morse potential. The propagation scheme is used to propagate classical distributions which do not obey the Heisenberg uncertainty principle. It is shown that the simple classical deterministic motion breaks down surprisingly fast in an anharmonic potential.

Finally, we discuss the possibility of using the scheme as a useful approach to quantum dynamics in many dimensions. To that end we present a Monte Carlo integration scheme using the norm of the propagator as a part of the sampling function. ©1995 American Institute of Physics.

Language: English
Publisher: American Institute of Physics
Year: 1995
Pages: 5387-5395
ISSN: 10897690 and 00219606
Types: Journal article
DOI: 10.1063/1.469266
ORCIDs: Henriksen, Niels Engholm

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