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Chapman & Hall/CRC eBooks

Linear operators and their matrix representations

Helmut Bez, Tony Croft

Published Jan 6, 2023• 0 citations
Publisher

Abstract

This chapter discusses the linear operator and demonstrate how one can be represented by a matrix. Two particularly important types of the linear operator are unitary operators and the self-adjoint operators. Following the measurement of an observable on a quantum state the post-measurement state is related to the eigenvectors of the operator and the possible measured values are its eigenvalues. Finally, given two linear operators, and say, we explain how their tensor product is calculated. A calligraphic font has been used to denote the linear operator, but occasionally we shall abuse this notation and simply denote by its matrix representation.

DOI
10.1201/9781003264569-11

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This chapter discusses the linear operator and demonstrate how one can be represented by a matrix. Two particularly important types of the linear operator are unitary operators and the self-adjoint operators. Following the measurement of an observable on a quantum state the post-measurement state is related to the eigenvectors of the operator and the possible measured values are its eigenvalues. Finally, given two linear operators, and say, we explain how their tensor product is calculated. A calligraphic font has been used to denote the linear operator, but occasionally we shall abuse this notation and simply denote by its matrix representation.
This chapter develops a basic working knowledge of operators — objects central to quantum mechanics. The fact that quantum operators are linear determines how they may be manipulated, so linearity forms the chapter's first topic. The adjoint of an operator is then introduced. This provides the basis for Hermitian or self-adjoint operators, which are discussed for both discrete eigenvalue systems and wavefunctions. Projection operators, which ‘project out’ a certain part of a quantum state, are then introduced. These form the basis for the identity operator — a sum over projection operators — which changes the representation in which a state is expressed without changing the state itself. Finally, unitary operators are briefly discussed, including the defining unitarity condition, the fact that such operators preserve inner products, and their physical meaning as effecting transformations in space and time. Unitary operators are discussed in greater detail in Appendix D.
With the postulates already formulated in the language of an abstract inner product spaces, this chapter shows how an observable can be naturally expressed as a linear Hermitian operator acting on the inner product space where the states live. We start by introducing linear operators acting on vector spaces and their representations. Next, we discuss the systems of eigenvalues and eigenvectors associated with such operators. The important case of Hermitian operator and the properties of their eigenvalues and eigenvectors, relevant to quantum mechanics, are introduced. After developing the necessary background in linear algebra, the connection of Hermitian operators with quantum observables is established. We then proceed to explain what this connection actually accomplishes. In particular, we show how it translates the target questions of quantum mechanics into an eigenvalue problem. This makes it evident what the nature of the input to a quantum theory should be. This input enters the formalism through what are known as “quantization rules”. I discuss this in the last section of this chapter. An illustration using a disguised spin-half system winds up the chapter.
Linear algebra is the natural mathematical language of quantum mechanics. For this reason, the present chapter starts with a review of Hilbert spaces for vectors and operators. We introduce vector and Hilbert spaces along with inner products and metrics. The Dirac notation is developed for the Euclidean vector spaces as a starting point for the concepts of complete orthonormal sets of vectors, closure, dual vector spaces, and adjoint operators. The Dirac delta function in various forms and the principal part is introduced in Appendix 5 as an essential tool. The chapter turns to the main use of Dirac notation for function spaces; the concepts of norm, inner product, and closure are discussed. Fourier, Cosine, and Sine series are discussed as examples of expansions in complete orthonormal sets of functions. Although Hilbert spaces are interesting mathematical objects with important physical applications, the study of linear algebra remains incomplete without a study of linear operators (i.e., linear transformations). In fact, the set of linear transformations itself forms a vector space and therefore has a basis set. The basis set for the operator is linked with the basis sets for the spaces that it operates between. The linear operator can be discussed as an abstract operator or through an isomorphism as a matrix or as a generalized expansion in operator space. A Hermitian (a.k.a., self-adjoint) operator produces a basis set within a Hilbert space. The basis set comes from the eigenvector equation for the particular operator. The fact that a Hermitian operator produces a complete set (of orthornomal vectors) has special importance for quantum mechanics. Observables such as energy or momentum correspond to Hermitian operators. Complete sets make it possible to represent every possible result of a measurement of the observable by an object (vector) in the theory. The Hermitian operators have real eigenvalues which represent the results of the measurement.
This chapter illustrates how one can obtain a matrix representation of a state vector, an operator, and an eigenvalue equation in a basis of orthonormal states. It helps to learn that matrix representations are very useful in calculations of the properties of operators, because algebra of matrices is very simple and completely developed. Readers familiar with the algebra of matrices agree that mathematical operations on matrices such as multiplication by a scalar, addition, subtraction, multiplication and diagonalization are simple and easy to perform. In fact, the application of the algebra of matrices to quantum physics results from the direct relations between operators and matrices that any mathematical relation that holds between operators also holds between the corresponding matrices. The eigenvalues and eigenvectors of the matrix representing a given operator  in the basis of orthonormal states are the same as the eigenvalues and eigenvectors of Â.
This chapter deals with the matrix and vector formulation of quantum mechanics. Topics covered under the chapter are: matrices and their basic algebra, bra and ket notations, vector space and the basis vectors, inner and outer products of vectors, the orthogonalization procedure for vectors, the Schwarz inequality, linear transformation of a vector, eigenvalues and eigenvectors of a matrix, numerical methods to find eigenvalue and eigenvector, different types of matrices used in quantum mechanics, diagonalization of a matrix, the Cayley-Hamilton theorem, change of basis in a vector space and the unitary transformations, infinite-dimensional and Hilbert spaces, representation of quantum states and operators in Hilbert space, the Schrödinger equation in matrix form, assumptions of quantum mechanics in matrix formulations, the general uncertainty principle, the one dimensional harmonic oscillator, solved examples and unsolved exercises. The objectives of this chapter are to introduce the important aspects of vector and matrix algebra that have been vital in the development and the description of modern quantum mechanics and in exhibiting that the Heisenberg and Schrödinger approaches to quantum mechanics are equivalent.
Operators represent physically observable quantities, as discussed in Section 2.5. The structure and property of operators depend on the nature of the degree of freedom; operators act on the state space and in particular on the state vector of a given degree of freedom. The significance of operators in the interpretation of quantum mechanics has been discussed in Baaquie (2013e). The operators discussed in this chapter are mostly based on the continuous degree of freedom, which is analyzed in Section 3.1. Hermitian operators represent physically observable properties of a degree of freedom and their mathematical properties are defined in Section 3.3. The coordinate and momentum operators are the leading exemplar of a pair of noncommuting Hermitian operators and these are studied in some detail in Section 3.4. The Weyl operators yield, as in Section 3.5, a finite-dimensional example of the shift and scaling operators; Section 3.8 provides a unitary representation of the coordinate and momentum operators. The term self-adjoint operator is used for Hermitian operators when there is a need to emphasize the importance of the domain of the Hilbert space on which the operators act – a topic not usually discussed in most books on quantum mechanics. Sections 3.10 and 3.11 discuss the concept of self-adjoint operators, in particular the crucial role played by the domain for realizing the property of self-adjointness. It is shown in Section 3.12 how the requirement of self-adjointness yields a non-trivial extension of Hamiltonians that include singular interactions.