Quantum Wave Packet Dynamics with Trajectories

Courtney L. Lopreore and Robert E. Wyatt
Phys. Rev. Lett. 82, 5190 – Published 28 June 1999
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Abstract

The de Broglie–Bohm causual (hydrodynamic) formulation of quantum mechanics is computationally implemented in the Lagrangian (moving with the fluid) viewpoint. The quantum potential and force are accurately evaluated with a moving weighted least squares algorithm. The quantum trajectory method is then applied to barrier tunneling on smooth potential surfaces. Analysis of the tunneling mechanism leads to a novel and accurate approximation: shortly after the wave packet is launched, completely neglect all quantum terms in the dynamical equations for motion along the tunneling coordinate.

  • Received 13 January 1999

DOI:https://doi.org/10.1103/PhysRevLett.82.5190

©1999 American Physical Society

Authors & Affiliations

Courtney L. Lopreore and Robert E. Wyatt

  • Institute for Theoretical Chemistry, The University of Texas at Austin, Austin, Texas 78712

Comments & Replies

Lopreore and Wyatt Reply:

Courtney L. Lopreore and Robert E. Wyatt
Phys. Rev. Lett. 85, 895 (2000)

Comment on “Quantum Wave Packet Dynamics with Trajectories”

Jordi Suñé and Xavier Oriols
Phys. Rev. Lett. 85, 894 (2000)

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Vol. 82, Iss. 26 — 28 June 1999

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