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Physical Review A

Semiclassical description of harmonic quantal Brownian motion

E. Susana Hernández, Horacio M. Cataldo

Published Feb 1, 1989• 8 citations
Publisher

Abstract

By means of the Wigner transformation procedure, we extract a generalized Fokker-Planck equation that represents the semiclassical version of the quantal master equation for Brownian harmonic motion. The Fokker-Planck equation and its solutions are investigated both in the Markovian and in the non-Markovian regimes. The relations between semiclassical and classical Brownian motion of harmonic oscillators are analyzed with special emphasis on the high-friction limit.

DOI
10.1103/physreva.39.2034

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•Jan 1, 1998•7 citations
By means of the Wigner transformation procedure, we extract a generalized Fokker-Planck equation that represents the semiclassical version of the quantal master equation for Brownian harmonic motion. The Fokker-Planck equation and its solutions are investigated both in the Markovian and in the non-Markovian regimes. The relations between semiclassical and classical Brownian motion of harmonic oscillators are analyzed with special emphasis on the high-friction limit.
We analyze the irreversible behavior of a quantum harmonic oscillator immersed in an arbitrary thermal reservoir. For the fully coupled (FC) model, i.e., the coupling between subsystems linear in the coordinate of the oscillator, we construct a generalized master equation for the reduced density operator of the oscillator. We apply the rotating-wave approximation (RWA) and investigate its connection with the FC master equation. By means of the Wigner distribution, we obtain the corresponding Fokker-Planck equations in the semiclassical representation. We find that, when the RWA is not imposed, the correct classical limit is obtained (Kramer's equation). Then, we establish the conditions for the equivalence between the FC Fokker-Planck equation and that obtained in the RWA. Quantum maps for a kicked oscillator immersed in a heat bath are obtained in both cases. These maps are studied in the classical and semiclassical limits, and it is shown that they coincide for low kicking frequency compared to the damping rate.
The solutions of the generalized Fokker-Planck equation that arises in the semiclassical description of a quantal harmonic coordinate immersed in an arbitrary heat bath are investigated in the non-Markovian regime. The treatment consists of retaining a finite number of terms of the analytic expansion of the Laplace-transformed memory kernel around the origin which leads to approximate relaxation frequencies involving different degrees of memory. For a regime of highly inelastic collisions the authors extend previous findings concerning the relation between Markovian and non-Markovian relaxation frequencies and, for the usual elastic coupling, they consider fermion and phonon environments showing that the former involves a much more complex dynamics with a non-exponential time decay. Focusing upon the exponential part of the decay, they find that for both classes of reservoirs the first two non-Markovian corrections have well defined signs that increase the relaxation frequencies.
The theory of Brownian motion of a quantum oscillator is developed. The Brownian motion is described by a model Hamiltonian which is taken to be the one describing the interaction between this oscillator and a reservoir. Use is made of the master equation recently derived by the author, to obtain the equation of motion for the various reduced phase-space distribution functions that are obtained by mapping the density operator onto ccc-number functions. The equations of motion for the reduced phase-space distribution functions are found to be of the Fokker-Planck type. On transforming the Fokker-Planck equation to real variables, it is found to have the same form as the Fokker-Planck equation obtained by Wang and Uhlenbeck to describe the Brownian motion of a classical oscillator. The Fokker-Planck equation is solved for the conditional probability (Green's function) which is found to be in the form of a two-dimensional Gaussian distribution. This solution is then used to obtain various time-dependent quantum statistical properties of the oscillator. Next, the entropy for a quantum oscillator undergoing Brownian motion is calculated and we show that this system approaches equilibrium as $t\ensuremath{\rightarrow}\ensuremath{\infty}$. Finally we show that in the weak-coupling limit the Fokker-Planck equation reduces to the one obtained by making the usual rotating-wave approximation.
Recent progress in our understanding of quantum effects on the Brownian motion in an external potential is reviewed. This problem is ubiquitous in physics and chemistry, particularly in the context of decay of metastable states, for example, the reversal of the magnetization of a single domain ferromagnetic particle, kinetics of a superconducting tunnelling junction, etc. Emphasis is laid on the establishment of master equations describing the diffusion process in phase space analogous to the classical Fokker-Planck equation. In particular, it is shown how Wigner's [E. P. Wigner, Phys. Rev., 1932, 40, 749] method of obtaining quantum corrections to the classical equilibrium Maxwell-Boltzmann distribution may be extended to the dissipative non-equilibrium dynamics governing the quantum Brownian motion in an external potential V(x), yielding a master equation for the Wigner distribution function W(x,p,t) in phase space (x,p). The explicit form of the master equation so obtained contains quantum correction terms up to o(h(4)) and in the classical limit, h --> 0, reduces to the classical Klein-Kramers equation. For a quantum oscillator, the method yields an evolution equation coinciding in all respects with that of Agarwal [G. S. Agarwal, Phys. Rev. A, 1971, 4, 739]. In the high dissipation limit, the master equation reduces to a semi-classical Smoluchowski equation describing non-inertial quantum diffusion in configuration space. The Wigner function formulation of quantum Brownian motion is further illustrated by finding quantum corrections to the Kramers escape rate, which, in appropriate limits, reduce to those yielded via quantum generalizations of reaction rate theory.
Traditionally, quantum Brownian motion is described by Fokker-Planck or diffusion equations in terms of quasiprobability distribution functions, e.g., Wigner functions. These often become singular or negative in the full quantum regime. In this paper a simple approach to non-Markovian theory of quantum Brownian motion using true probability distribution functions is presented. Based on an initial coherent state representation of the bath oscillators and an equilibrium canonical distribution of the quantum mechanical mean values of their coordinates and momenta, we derive a generalized quantum Langevin equation in c numbers and show that the latter is amenable to a theoretical analysis in terms of the classical theory of non-Markovian dynamics. The corresponding Fokker-Planck, diffusion, and Smoluchowski equations are the exact quantum analogs of their classical counterparts. The present work is independent of path integral techniques. The theory as developed here is a natural extension of its classical version and is valid for arbitrary temperature and friction (the Smoluchowski equation being considered in the overdamped limit).
We analyze quantal Brownian motion in ddd dimensions using the unified model for diffusion localization and dissipation, and Feynman-Vernon formalism. At high temperatures the propagator possess a Markovian property and we can write down an equivalent Master equation. Unlike the case of the Zwanzig-Caldeira-Leggett model, genuine quantum mechanical effects manifest themselves due to the disordered nature of the environment. Using Wigner picture of the dynamics we distinguish between two different mechanisms for destruction of coherence. The analysis of dephasing is extended to the low temperature regime by using a semiclassical strategy. Various results are derived for ballistic, chaotic, diffusive, both ergodic and non-ergodic motion. We also analyze loss of coherence at the limit of zero temperature and clarify the limitations of the semiclassical approach. The condition for having coherent effect due to scattering by low-frequency fluctuations is also pointed out. It is interesting that the dephasing rate can be either larger or smaller than the dissipation rate, depending on the physical circumstances.