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Physical Review Letters

Quantum Backreaction through the Bohmian Particle

Oleg V. Prezhdo, Craig Brooksby

Published Apr 9, 2001• 153 citations
Publisher

Abstract

A novel solution to the quantum backreaction problem in a mixed quantum-classical simulation is provided using the Bohmian interpretation of quantum mechanics. The Bohmian backreaction is unique, computationally simple, features reaction channel branching, and easily gives the full classical limit. The Bohmian quantum-classical method is illustrated by application to a model of O2 interacting with a Pt surface.

DOI
10.1103/physrevlett.86.3215

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Comment on “Quantum Backreaction through the Bohmian Particle”

L. L. Salcedo

In this Comment I point out some limitations of the proposal of Prezhdo and Brooksby for coupling quantum and classical degrees of freedom (Phys.Rev.Lett.86(2001)3215) if it is pushed too far.

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A novel solution to the quantum backreaction problem in a mixed quantum-classical simulation is provided using the Bohmian interpretation of quantum mechanics. The Bohmian backreaction is unique, computationally simple, features reaction channel branching, and easily gives the full classical limit. The Bohmian quantum-classical method is illustrated by application to a model of O2 interacting with a Pt surface.
The coupled Schrödinger equations that describe nonadiabatic dynamics are recast using the Bohm formulation of quantum mechanics. The resulting coupled Bohm equations are solved numerically for two scattering models, giving results that are essentially identical to wave-packet solution of the original coupled Schrödinger equations. The classical limit of the set of coupled Bohm equations is then described, producing a mixed quantum-classical theory incorporating classical-like motion on each potential energy surface accompanied by quantum transitions between the quantum states. Numerical tests of the mixed quantum-classical method are in excellent agreement with the accurate full-quantum results for the model problems. The method is contrasted with the related surface-hopping approach. It is shown that computing the dynamics of a distribution of classical particles is more consistent and more accurate than computing the motion of independent point particles as with surface hopping.
Bohmian mechanics is endowed with an ontological package that supposedly allows to solve the main interpretational problems of quantum mechanics. We are concerned in this work by the emergence of classicality from the quantum mechanical substrate. We will argue that although being superficially attractive, the de Broglie-Bohm interpretation does not shed new light on the quantum-to-classical transition. This is due to nature of the dynamical law of Bohmian mechanics by which the particles follow the streamlines of the probability flow. As a consequence, Bohmian trajectories can be highly non-classical even when the wavefunction propagates along classical trajectories, as happens in semiclassical systems. In order to account for classical dynamics, Bohmian mechanics needs non-spreading and non-interfering wave packets: this is achieved for practical purposes by having recourse to decoherence and dense measurements. However one then faces the usual fundamental problems associated with the meaning of reduced density matrices. Moreover the specific assets of the de Broglie-Bohm interpretation – in particular the existence of point-like particles pursuing well-defined trajectories – would play no role in accounting for the emergence of classical dynamics.
Bohmian mechanics is an alternative interpretation of quantum mechanics. We outline the main characteristics of its non-relativistic formulation. Most notably it does provide a simple solution to the infamous measurement problem of quantum mechanics. Presumably the most common objection against Bohmian mechanics is based on its non-locality and its apparent conflict with relativity and quantum field theory. However, several models for a quantum field theoretical generalization do exist. We give a non-technical account of some of these models.
According to Standard Quantum Mechanics (SQM), known as the Copenhagen Interpretation, the complete description of a system of particles is provided by its wave function. However, in the de Broglie-Bohm theory of Bohmian Quantum Mechanics (BQM), the additional element which is introduced apart from the wave function is the particle position, conceived in the classical sense as pursuing a definite continuous track in space-time. In BQM formulation, depending on the configuration of the potential barrier and the energy of the packet, the particle trajectories have been shown to take distinct paths. We will consider several barrier heights and show that in a Bohmian interpretation of the problem, there is no such thing as Quantum Tunnelling.
Bohmian mechanics is a realistic interpretation of quantum theory. It shares the same ontology of classical mechanics: particles following continuous trajectories in space through time. For this ontological continuity, it seems to be a good candidate for recovering the classical limit of quantum theory. Indeed, in a Bohmian framework, the issue of the classical limit reduces to showing how classical trajectories can emerge from Bohmian ones, under specific classicality assumptions. In this paper, we shall focus on a technical problem that arises from the dynamics of a Bohmian system in bounded regions; and we suggest that a possible solution is supplied by the action of environmental decoherence. However, we shall show that, in order to implement decoherence in a Bohmian framework, a stronger condition is required (disjointness of supports) rather than the usual one (orthogonality of states).