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Physical Review A

Integration of the Schrödinger equation by canonical transformations

Gin-yih Tsaur, Jyhpyng Wang

Published Dec 10, 2001• 11 citations
Publisher

Abstract

Owing to the operator nature of the quantum dynamical variables, classical canonical transformations for integrating the equations of motion cannot be extended to the quantum domain. In this paper, a general procedure is developed to construct the sequences of quantum canonical transformations for integrating the Schr\"odinger equations. The sequence is made of three elementary canonical transformations that constitute a much larger class than the unitary transformations. In conjunction with the procedure, we also developed a factorization technique that is analogous to the method of integration factor in classical integration. For demonstration, with the same procedure we integrate nine nontrivial models, including the centripetal barrier potential, the Kratzer's molecular potential, the Morse potential, the P\"oschl-Teller potential, the Hulth\'en potential, etc.

DOI
10.1103/physreva.65.012104

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Owing to the operator nature of the quantum dynamical variables, classical canonical transformations for integrating the equations of motion cannot be extended to the quantum domain. In this paper, a general procedure is developed to construct the sequences of quantum canonical transformations for integrating the Schr"odinger equations. The sequence is made of three elementary canonical transformations that constitute a much larger class than the unitary transformations. In conjunction with the procedure, we also developed a factorization technique that is analogous to the method of integration factor in classical integration. For demonstration, with the same procedure we integrate nine nontrivial models, including the centripetal barrier potential, the Kratzer's molecular potential, the Morse potential, the P"oschl-Teller potential, the Hulth'en potential, etc.
Three elementary canonical transformations are shown both to have quantum implementations as finite transformations and to generate, classically and infinitesimally, the full canonical algebra. A general canonical transformation can, in principle, be realized quantum mechanically as a product of these transformations. It is found that the intertwining of two super-Hamiltonians is equivalent to there being a canonical transformation between them. A consequence is that the procedure for solving a differential equation can be viewed as a sequence of elementary canonical transformations trivializing the super-Hamiltonian associated to the equation. It is proposed that the quantum integrability of a system is equivalent to the existence of such a sequence.
The initial value problem in quantum mechanics is most conveniently solved by the Green function method. Instead of the conventional methods of eigenfunction expansion and path integration, we present a new method for constructing the Green functions systematically. By using suitable elementary transformations, one of the conjugate variables in the Hamiltonian can be eliminated and the Green function for the simplified Hamiltonian can be easily derived. We then obtain the Green function for the original Hamiltonian by the reverse sequence of the elementary transformations. The method is illustrated for the linear potential, the harmonic oscillator, the centrifugal potential, and the centripetal barrier oscillator.
Quantum canonical transformations are defined algebraically outside of a Hilbert space context. This generalizes the quantum canonical transformations of Weyl and Dirac to include non-unitary transformations. The importance of non-unitary transformations for constructing solutions of the Schrödinger equation is discussed. Three elementary canonical transformations are shown both to have quantum implementations as finite transformations and to generate, classically and infinitesimally, the full canonical algebra. A general canonical transformation can be realized quantum mechanically as a product of these transformations. Each transformation corresponds to a familiar tool used in solving differential equations, and
Quantum canonical transformations are defined algebraically outside of a Hilbert space context. This generalizes the quantum canonical transformations of Weyl and Dirac to include non-unitary transformations. The importance of non-unitary transformations for constructing solutions of the Schr\\"odinger equation is discussed. Three elementary canonical transformations are shown both to have quantum implementations as finite transformations and to generate, classically and infinitesimally, the full canonical algebra. A general canonical transformation can be realized quantum mechanically as a product of these transformations. Each transformation corresponds to a familiar tool used in solving differential equations, and the procedure of solving a differential equation is systematized by the use of the canonical transformations. Several examples are done to illustrate the use of the canonical transformations. [This is an extensively revised version of hep-th-9205080: the first third of the paper is new material; the notation has been simplified, and further discussion has been added to the remainder.]
A canonical transformation changes variables such as coordinates and momenta to new variables preserving either the Poisson bracket or the commutation relations depending on whether the problem is classical or quantal respectively. Classically canonical transformations are well established as a powerful tool for solving differential equations. Quantum canonical transformations have been defined and used relatively recently because of the non-commutativeness of the quantum variables. Three elementary canonical transformations and their composite transformations have quantum implementations. Quantum canonical transformations have been mostly used in time-independent Schrodinger equations and a harmonic oscillator with time-dependent angular frequency is probably the only time-dependent problem solved by these transformations. In this work, we apply quantum canonical transformations to a harmonic oscillator in which both angular frequency and equilibrium position are time-dependent.
This paper is a generalization of previous work on the use of classical canonical transformations to evaluate Hamiltonian path integrals for quantum-mechanical systems. Relevant aspects of the Hamiltonian path integral and its measure are discussed, and used to show that the quantum-mechanical version of the classical transformation does not leave the measure of the path-integral invariant, instead inducing an anomaly. The relation to operator techniques and ordering problems is discussed, and special attention is paid to incorporation of the initial and final states of the transition element into the boundary conditions of the problem. Classical canonical transformations are developed to render an arbitrary power potential cyclic. The resulting Hamiltonian is analyzed as a quantum system to show its relation to known quantum-mechanical results. A perturbative argument is used to suppress ordering-related terms in the transformed Hamiltonian in the event that the classical canonical transformation leads to a nonquadratic cyclic Hamiltonian. The associated anomalies are analyzed to yield general methods to evaluate the path integral's prefactor for such systems. The methods are applied to several systems, including linear and quadratic potentials, the velocity-dependent potential, and the time-dependent harmonic oscillator.