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2 Linear Algebra

Chris Bernhardt

Published Jan 1, 2019• 0 citations
OpenAlex

Abstract

Quantum mechanics is based on linear algebra. The general theory uses infinite dimensional vector spaces. Fortunately for us, to describe spin or polarization we need only finite dimensions, which makes things much easier. In fact, we need only a few tools. At the end of this chapter I have given a list. The rest of the chapter explains how to use these tools and what the calculations mean. There are many examples. It is important to work carefully through all of them. The mathematics introduced here is essential to everything that follows. Like much mathematics, it can seem complicated when it is first introduced, but it becomes almost second nature with practice. The actual computations only involve addition and multiplication of numbers, along with an occasional square root and trigonometric function.

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In Chapter 4 we saw that the canonical commutation relations force us to use a space of states of infinite dimension, in which rigor would require the use of advanced mathematical tools. Fortunately, physicists generally need only to carry the results for finite dimension over to infinite dimension with some simple modifications which we shall indicate here, without embarking on sophisticated mathematics. Nevertheless, it is useful to be aware of the lapses in rigor which are customarily made in physics in order to avoid possible unpleasant surprises. The objective of this chapter is, on the one hand, to present some concrete examples illustrating the new features which arise in infinite dimension and, on the other, to give the rules for practical calculations, in particular to write down the spectral decomposition of Hermitian and unitary operators. The mathematics we use is a bit more detailed than commonly found in most quantum mechanics textbooks. The reader interested purely in the practical aspects can proceed directly to Section 7.3, where the results essential for later on are summarized. Hilbert spaces Definitions The space of states of quantum mechanics is a Hilbert space ℌ, which in general is of infinite dimension. The axiomatic definition of a Hilbert space is the following. It is a vector space which, for the needs of quantum mechanics, is defined on complex numbers. The vectors of this space are denoted |ϕ〉. […]

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Chapter 4

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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.

CRC Press eBooks•Oct 3, 2018•0 citations
Quantum mechanics is based on linear algebra. The general theory uses infinite dimensional vector spaces. Fortunately for us, to describe spin or polarization we need only finite dimensions, which makes things much easier. In fact, we need only a few tools. At the end of this chapter I have given a list. The rest of the chapter explains how to use these tools and what the calculations mean. There are many examples. It is important to work carefully through all of them. The mathematics introduced here is essential to everything that follows. Like much mathematics, it can seem complicated when it is first introduced, but it becomes almost second nature with practice. The actual computations only involve addition and multiplication of numbers, along with an occasional square root and trigonometric function.
In Chapter 4 we saw that the canonical commutation relations force us to use a space of states of infinite dimension, in which rigor would require the use of advanced mathematical tools. Fortunately, physicists generally need only to carry the results for finite dimension over to infinite dimension with some simple modifications which we shall indicate here, without embarking on sophisticated mathematics. Nevertheless, it is useful to be aware of the lapses in rigor which are customarily made in physics in order to avoid possible unpleasant surprises. The objective of this chapter is, on the one hand, to present some concrete examples illustrating the new features which arise in infinite dimension and, on the other, to give the rules for practical calculations, in particular to write down the spectral decomposition of Hermitian and unitary operators. The mathematics we use is a bit more detailed than commonly found in most quantum mechanics textbooks. The reader interested purely in the practical aspects can proceed directly to Section 7.3, where the results essential for later on are summarized. Hilbert spaces Definitions The space of states of quantum mechanics is a Hilbert space ℌ, which in general is of infinite dimension. The axiomatic definition of a Hilbert space is the following. It is a vector space which, for the needs of quantum mechanics, is defined on complex numbers. The vectors of this space are denoted |ϕ〉. […]
In this second chapter we will review the basic mathematical and physical facts about quantum mechanics and establish physical units and notation. Those readers already familiar with the subject can safely jump to the next chapter. An attempt has been made to make the presentation in this chapter as elementary as possible, and yet present the basic facts that will be needed later. There are many beautiful and important topics which will not be touched upon such as self-adjointness of Schrödinger operators, the general mathematical structure of quantum mechanics and the like. These topics are well described in other works, e.g.. Much of the following can be done in a Euclidean space of arbitrary dimension, but in this chapter the dimension of the Euclidean space is taken to be three-which is the physical case-unless otherwise stated. We do this to avoid confusion and, occasionally, complications that arise in the computation of mathematical constants. The interested reader can easily generalize what is done here to the R d , d > 3 case. Likewise, in the next chapters we mostly consider N particles, with spatial coordinates in R 3 , so that the total spatial dimension is 3 N . A Brief Review of the Connection Between Classical and Quantum Mechanics Considering the range of validity of quantum mechanics, it is not surprising that its formulation is more complicated and abstract than classical mechanics. Nevertheless, classical mechanics is a basic ingredient for quantum mechanics. One still talks about position, momentum and energy which are notions from Newtonian mechanics.
We assume the reader has a strong background in elementary linear algebra. In this section we familiarize the reader with the algebraic notation used in quantum mechanics, remind the reader of some basic facts about complex vector spaces, and introduce some notions that might not have been covered in an elementary linear algebra course. The linear algebra notation used in quantum computing will likely be familiar to the student of physics, but may be alien to a student of mathematics or computer science. It is the Dirac notation, which was invented by Paul Dirac and which is used often in quantum mechanics. In mathematics and physics textbooks, vectors are often distinguished from scalars by writing an arrow over the identifying symbol: e.g a⃗. Sometimes boldface is used for this purpose: e.g. a. In the Dirac notation, the symbol identifying a vector is written inside a ‘ket’, and looks like |a⟩. We denote the dual vector for a (defined later) with a ‘bra’, written as ⟨a|. Then inner products will be written as ‘bra-kets’ (e.g. ⟨a|b⟩). We now carefully review the definitions of the main algebraic objects of interest, using the Dirac notation. The vector spaces we consider will be over the complex numbers, and are finite-dimensional, which significantly simplifies the mathematics we need. Such vector spaces are members of a class of vector spaces called Hilbert spaces. Nothing substantial is gained at this point by defining rigorously what a Hilbert space is, but virtually all the quantum computing literature refers to a finite-dimensional complex vector space by the name ‘Hilbert space’, and so we will follow this convention. We will use H to denote such a space. Since H is finite-dimensional, we can choose a basis and alternatively represent vectors (kets) in this basis as finite column vectors, and represent operators with finite matrices. As you see in Section 3, the Hilbert spaces of interest for quantum computing will typically have dimension 2n, for some positive integer n. This is because, as with classical information, we will construct larger state spaces by concatenating a string of smaller systems, usually of size two.
Abstract With this chapter, we begin to transit from digital information processing to quantum information processing. However, to be able to master this transition, we first need to familiarize ourselves with quantum mechanical principles and the mathematics used to describe them. Since we already know about abstract state spaces, tensor products, and Hamiltonian operators and their eigenvectors and eigenvalues, this should not be too difficult or too alien. And yet, there remain a few challenges: Mathematical descriptions of quantum states usually involve the Dirac notation, require complex linear algebra in high dimensional spaces, and encode unintuitive probabilistic interpretations. Rising to these challenges, we briefly study the notion of Hilbert spaces, introduce the Dirac notation, and discuss the axioms of quantum mechanics and some of their consequences. All this will admittedly be dense and abstract but prepare us for everything that is still to follow. Our main goal is to emphasize that quantum mechanics and therefore quantum computing is just complex linear algebra in very high dimensional spaces so that quantum computing needs a different kind of thinking than we are used to in digital computing.
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.