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CRC Press eBooks

The Quasiclassical Approximation

A. B. Migdal

Published Mar 5, 2018• 0 citations
Publisher

Abstract

This chapter considers an approximate method of solving the Schrodinger equation in the case when the wavelength of the particle is small by comparison with the distance over which the potential changes appreciably. Since the limit of short wavelength corresponds to the limit of classical mechanics, the quasiclassical approximation allows to explore the relation between classical and quantum mechanics. The chapter discusses how to match the quasiclassical wave function f in the region accessible to classical motion with the wave function in the forbidden region. Since the action function is a minimum along the classical trajectory, the pencil of trajectories adjacent to the classical one gives the minimum phase factor. The chapter examines the problem of the escape of a particle from a potential barrier; this problem reduces to the problem of the spreading of a wave packet which describes a particle which at the initial time was inside the barrier.

DOI
10.1201/9780429497940-3

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This chapter considers an approximate method of solving the Schrodinger equation in the case when the wavelength of the particle is small by comparison with the distance over which the potential changes appreciably. Since the limit of short wavelength corresponds to the limit of classical mechanics, the quasiclassical approximation allows to explore the relation between classical and quantum mechanics. The chapter discusses how to match the quasiclassical wave function f in the region accessible to classical motion with the wave function in the forbidden region. Since the action function is a minimum along the classical trajectory, the pencil of trajectories adjacent to the classical one gives the minimum phase factor. The chapter examines the problem of the escape of a particle from a potential barrier; this problem reduces to the problem of the spreading of a wave packet which describes a particle which at the initial time was inside the barrier.
In this chapter, the Schrödinger equation is “derived” for particles that can be described by de Broglie waves. The Schrödinger equation is very different from the corresponding equation of motion in classical mechanics. In order to illustrate the fundamental differences between the two theories, one of the simplest problems of particle dynamics is solved in both Newtonian and quantum mechanics. This simple example also helps to show that quantum mechanics is the fundamental theory and classical mechanics is an approximation, a remarkably good approximation, when considering macroscopic objects. The solution of the Schrödinger equation is presented for a particle inside a box and the quantization condition is derived. The amazing possibility of quantum tunneling when a particle is incident on a barrier of height larger than the energy of the incident particle is also discussed. Finally the three-dimensional Schrödinger equation is solved for the hydrogen atom.
We review various methods of deriving expressions for quantum-mechanical quantities in the limit when hslash is small (in comparison with the relevant classical action functions). To start with we treat one-dimensional problems and discuss the derivation of WKB connection formulae (and their reversibility), reflection coefficients, phase shifts, bound state criteria and resonance formulae, employing first the complex method in which the classical turning points are avoided, and secondly the method of comparison equations with the aid of which uniform approximations are derived, which are valid right through the turningpoint regions. The special problems associated with radial equations are also considered. Next we examine semiclassical potential scattering, both for its own sake and also as an example of the three-stage approximation method which must generally be employed when dealing with eigenfunction expansions under semiclassical conditions, when they converge very slowly. Finally, we discuss the derivation of semiclassical expressions for Green functions and energy level densities in very general cases, employing Feynman's path-integral technique and emphasizing the limitations of the results obtained. Throughout the article we stress the fact that all the expressions obtained involve quantities characterizing the families of orbits in the corresponding purely classical problems, while the analytic forms of the quantal expressions depend on the topological properties of these families. This review was completed in February 1972.
We present a time-dependent semiclassical method based on quantum trajectories. Quantum-mechanical effects are described via the quantum potential computed from the wave function density approximated as a linear combination of Gaussian fitting functions. The number of the fitting functions determines the accuracy of the approximate quantum potential (AQP). One Gaussian fit reproduces time-evolution of a Gaussian wave packet in a parabolic potential. The limit of the large number of fitting Gaussians and trajectories gives the full quantum-mechanical result. The method is systematically improvable from classical to fully quantum. The fitting procedure is implemented as a gradient minimization. We also compare AQP method to the widely used semiclassical propagator of Herman and Kluk by computing energy-resolved transmission probabilities for the Eckart barrier from the wave packet time-correlation functions. We find the results obtained with the Herman–Kluk propagator to be essentially equivalent to those of AQP method with a one-Gaussian density fit for several barrier widths.
In this paper we consider the time evolution of wave-packet tunneling through a potential barrier. Using a path-summation approach, we can describe the quantum evolution in terms of particle trajectories both in the allowed and forbidden regions. Near the barrier edges, where the potential changes rapidly, the wave aspects dominate. These make the trajectories branch into infinite families of paths, which have to be included in the summation. Combining these features, we treat correctly the complementary aspects of the full quantum process, and this allows us to obtain a computational method that gives accurate numerical results with considerably less expenditure of computer time than a direct integration of the Schr\"odinger equation. We test the method on a simple rectangular potential by comparing the calculations with both conventional wave scattering results and computations from the Schr\"odinger equation. A general potential can be approximated by a staircase, which allows the application of our method. A simple adiabatic extension is shown to work excellently for the case of a periodically modulated barrier.
This chapter discusses the connection between the classical and semiclassical domains of scattering. Scattering phenomena may be described via three regimes: the scattering of waves by objects with small, large, or comparable sizes with the wavelength of the incident (plane wave) radiation. All three regions can be related to three domains: the classical domain (geometrical optics, particle and particle/ray-like trajectories); the wave domain (physical optics, acoustic and electromagnetic waves, quantum mechanics); and the semiclassical domain (the vast intermediate region between the first and second domain). The chapter first provides an overview of classical and semiclassical scattering domains before beginning with an analysis of the semiclassical formulation. It also considers the radial equation, scattering by a one-dimensional potential barrier, and the radially symmetric problem. Solutions for phase shifts and the potential well are presented.
The Schrödinger equation is a fundamental equation in physics for describing quantum mechanical behavior. It is a partial differential equation that shows how a wave function of a physical system evolves over time. In addition, it is associated with the kinetic energy and the potential energy, both of which contribute towards the total energy. This paper explains mathematical aspect of the Schrödinger equation. The concept of the WKB approximation has also been reviewed, which is an important method in finding the approximate solutions for the wave function. In addition, the paper also shows how to derive the transmission and reflection probabilities in relation to a one-dimensional quantum problem, called a “tunneling problem”, which occurs when a classical particle passes through a region where total energy is less than its potential energy. The WKB approximation can be used as a basis for formally writing down the exact solutions. Furthermore, it gives a high accuracy for the propagation of waves with high frequency or short wavelength.