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International Journal of Quantum Chemistry

Harmonic oscillator tensors. I. The nondegenerate case

Pancracio Palting

Published Oct 1, 1991• 10 citations
Publisher

Abstract

Abstract It is shown that the Heisenberg Lie algebra of the nondegenerate harmonic oscillator leads to a basis {J+, J0, J−} of LASU(2). The Hamiltonian of the system is proportional to J0, and the basis elements give rise to irreducible tensors in the associative enveloping algebra of the Heisenberg Lie algebra. The construction of these irreducible tensors is studied with special attention being paid to the case in which they act upon a single vector space spanned by the harmonic oscillator basis functions. A tensor coupling rule is developed, and useful application is made of it in the calculation of general expressions for vibrational operators and their matrix elements. Throughout, the value of the additional algebraic quantum numbers (l, m) is emphasized.

DOI
10.1002/qua.560400403

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Abstract It is shown that the Heisenberg Lie algebra of the nondegenerate harmonic oscillator leads to a basis {J+, J0, J−} of LASU(2). The Hamiltonian of the system is proportional to J0, and the basis elements give rise to irreducible tensors in the associative enveloping algebra of the Heisenberg Lie algebra. The construction of these irreducible tensors is studied with special attention being paid to the case in which they act upon a single vector space spanned by the harmonic oscillator basis functions. A tensor coupling rule is developed, and useful application is made of it in the calculation of general expressions for vibrational operators and their matrix elements. Throughout, the value of the additional algebraic quantum numbers (l, m) is emphasized.
The harmonic oscillator is a useful model for the interpretation of many physical phenomena. It is used as a first approximation to the vibration of molecules and crystal lattices and for the quantization of electromagnetic fields, among other applications. One can solve the time-independent Schrodinger equation for the harmonic oscillator in many different ways; operator methods give rise to recurrence relations and generating functions for the stationary states. The coordinate representation renders the coordinate operator diagonal. In this particular representation the eigenvectors of the harmonic oscillator are functions of the coordinate that are commonly expressed in terms of Hermite polynomials. The chapter shows that calculation with the eigenfunctions of the harmonic oscillator is remarkably simple in the realm of the Lie algebras. The application of the bosonic algebra in theoretical physics and chemistry is so vast that it is impossible even to give a reasonable summary. An important application of the bosonic algebra is the modeling of simple quantum-mechanical systems.
Abstract In this paper, the matrix elements explicit expressions for the kernel operator in the harmonic oscillator eigenfunctions basis are obtained. The matrix elements are expressed in terms of the two complex variables new polynomials that were constructed in this paper. In the particular case, new polynomials degenerate into Laguerre polynomials. The diagonal elements of the kernel operator matrix are the Wigner functions of the harmonic oscillator, which do not introduce dissipation into the quantum system. The off-diagonal elements contain frequency oscillations responsible for dissipations in the quantum systems. Using the explicit representation of the kernel operator matrix elements, we construct the distributions of the Wigner function in the phase space for quantum systems.
We study the known coherent states of a quantum harmonic oscillator from the standpoint of the originally developed noncommutative integration method for linear partial differential equations. The application of the method is based on the symmetry properties of the Schrödinger equation and on the orbit geometry of the coadjoint representation of Lie groups. We have shown that analogs of coherent states constructed by the noncommutative integration can be expressed in terms of the solution to a system of differential equations on the Lie group of the oscillatory Lie algebra. The solutions constructed are directly related to irreducible representation of the Lie algebra on the Hilbert space functions on the Lagrangian submanifold to the orbit of the coadjoint representation.
We study the known coherent states of a quantum harmonic oscillator from the standpoint of the original developed noncommutative integration method for linear partial differential equations. The application of the method is based on the symmetry properties of the Schrödinger equation and on the orbit geometry of the coadjoint representation of Lie groups. We have shown that analogs of coherent states constructed by the noncommutative integration can be expressed in terms of the solution of a system of differential equations on the Lie group of the oscillatory Lie algebra. The solutions constructed are directly related to irreducible representation of the Lie algebra on the Hilbert space functions on the Lagrangian submanifold to the orbit of the coadjoint representation.
We show the use of the theory of Lie algebras, especially their oscillator realizations, in the context of quantum mechanics. One can construct oscillator realizations from matrix realizations. In the case of symplectic and special orthogonal algebra, we demonstrate an alternative method of obtaining oscillator realizations from symmetric or exterior power of a vector space of annihilation and creation bosonic or fermionic operators. We find Lie algebra of polynomials of degree at most two in phase space of a mechanical system, which form the semi-direct product of the Heisenberg algebra and symplectic algebra. It is shown that a classical system with Hamiltonian function in this algebra can be quantized by two equivalent representations - Schrödinger or Bargmann-Fock representation. The second mentioned representation generates the same operators of symplectic algebra as we got from their previous formal construction from symmetric power of a vector space of bosonic operators. Quantization is demonstrated on the bosonic harmonic oscillator. We use the similarities between bosonic and fermionic oscillator realizations to define the fermionic harmonic oscillator. Some properties of spinor representations of special orthogonal algebra are illustrated on its state space. Powered by TCPDF (www.tcpdf.org)
We study the quantum mechanical harmonic oscillator in two and three dimensions, with particular attention to the solutions as basis states for representing their respective symmetry groups — O(2), O(1,1), O(3), and O(2,1). The goal of this study is to establish a correspondence between Hilbert space descriptions found by solving the Schrodinger equation in polar coordinates, and Fock space descriptions constructed by expressing the symmetry operators in terms of creation/annihilation operators. We obtain wavefunctions characterized by a principal quantum number, the group Casimir eigenvalue, and one group generator whose eigenvalue is m + s , for integer m and real constant parameter s . For the three groups that contain O(2), the solutions split into two inequivalent representations, one associated with s = 0, from which we recover the familiar description of the oscillator as a product of one-dimensional solutions, and the other with s > 0 (in three dimensions, solutions are found for s = 0 and s = 1/2) whose solutions are non-separable in Cartesian coordinates, and are hence overlooked by the standard Fock space approach. The O(1,1) solutions are singlet states, restricted to zero eigenvalue of the symmetry operator, which represents the boost, not angular momentum. For O(2), a single set of creation and annihilation operators forms a ladder representation for the allowed oscillator states for any s, and the degeneracy of energy states is always finite. However, in three dimensions, the integer and half-integer eigenstates are qualitatively different: the former can be expressed as finite dimensional irreducible tensors under O(3) or O(2,1) while the latter exhibit infinite degeneracy. Creation operators that produce the allowed integer states by acting on the non-degenerate ground state are constructed as irreducible tensor products of the fundamental vector representation. However, the half-integer eigenstates are infinite-dimensional, as expected for the non-compact O(2,1), and no Fock space description is found for this case. For all s ≠ 0 solutions, the SU(N) symmetry of the harmonic oscillator Hamiltonian recently discovered by Bars is spontaneously broken by the ground state. The connection of this symmetry breaking to the non-separability into one-dimensional Cartesian solutions is demonstrated. We conclude with a discussion of the O(2,1) solutions, and the problem of timelike ghost excitations.