Documente Academic
Documente Profesional
Documente Cultură
der Physik
Fortschr. Phys. 63, No. 910, 644658 (2015) / DOI 10.1002/prop.201500023
Progress
Review Paper
of Physics
Review Paper
of Physics
C 2015 WILEY-VCH Verlag GmbH & Co. KGaA, Weinheim Wiley Online Library 645
Fortschritte
der Physik
K. S. Ranade: Functional analysis and quantum mechanicsan introduction
Progress
Review Paper
of Physics
0.5
2.3 Hilbert spaces
0.2
Definition 1 (Hilbert space). A pre-Hilbert space is a vec-
tor space over some field K equipped with a scalar product
0.1 (or inner product), i. e. a function | : V V K with
the following three properties:
2 4
1. sesquilinearity: x|v + w = x|v + x|w and
Figure 1 A wavefunction with imaginary eigenvalue. v + w|x = v|x + w|x,
2. anti-symmetry: w|v = v|w and
2.2 Linear algebra and functional analysis 3. positive definiteness: v|v > 0 for v = 0.
In the previous examples we have used concepts A Hilbert space is a pre-Hilbert space which is com-
familiar from linear algebra, which work well in plete (in the sense of metric spaces, i. e. every Cauchy se-
finite-dimensional systems. But very often quantum- quence converges with a limit in the space itself). A real or
mechanical systems need infinite-dimensional Hilbert complex Hilbert space is a Hilbert space, where K = R or
spaces (e. g. for a particle in space). Let us summarise: K = C, respectively.5
Though completeness is not explicitly used in
1. We often use terminology and methods of linear al-
physics, it is necessary for certain mathematical the-
gebra, such as vector spaces, bases, scalar products,
orems. From now on, we shall only consider complex
orthogonality, matrices and their diagonalisation,
Hilbert spaces, and H shall always denote such a com-
operators etc.
plex Hilbert space. Hilbert spaces are essentially defined
2. Most quantum systemsnotable exceptions are spin
by their bases.
systems have infinite dimension: a free particle, a
particle in a box, a particle in a harmonic oscillator, Definition 2 (Bases of Hilbert spaces). A basis (more pre-
the Hydrogen atom etc. cisely, an orthonormal basis) of H is a set B of vectors in H,
3. A mathematically rigorous description thus must such that there holds (i) v|w = v,w for all v, w B and
make use of functional analysis, in some sense lin- (ii) x = vB xx|v for all x H.
ear algebra in infinite-dimensional vector spaces. A Hilbert space which is very important for quantum
4. Many aspects of linear algebra extend to functional mechanics is the space L2 (R) of square-integrable func-
analysis, but not all, and even if they do, several the- tions.6 Note that the uncountable position and momen-
orems and statements are much more complicated tum bases are not true bases, since neither plane waves
than is expected at first sight. nor delta functions are square-integrable functions.
It is very easy to give a formal classification of Hilbert
At this point we cannot show how to resolve the prob-
spaces in purely mathematical terms. However, it will be
lems posed in detail, for which we refer to the references
already mentioned, but we can give some brief explana-
tion: In the first example the trace is simply not defined 5 Note that the notation in mathematics and physics differs: the
on all operators on a Hilbert space, but only on a subset
complex conjugate of z C is denoted z in mathematics and
called the trace-class operators. In the second example
z in physics, the adjoint A and A , respectively. The scalar
we get by differentiating delta distributions at a and a, product in usually linear in the left component in mathemat-
which we cannot ignore in our calculation. The third ex- ics and in the right component in physics. In older mathemat-
ample show, that on infinite-dimensional spaces we have ics literature and sometimes in physics Hilbert spaces are occa-
to consider domains of definition. In the fourth exam- sionally required to be infinite-dimensional and/or separable;
ple, we presented the applications of x3 p and px3 on the cf. e. g. von Neumann [11] or Scheck [12].
1/4x2
function separately; these map f to e 22 i (x3/2 3x1/2 ), 6 This is strictly speaking not true; a precise definition will follow,
respectively, which are not square-integrable, but their when we discuss measure and integration theory.
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Fortschr. Phys. 63, No. 910 (2015)
Progress
Review Paper
of Physics
seen that it is not the different Hilbert spaces which dis- zero (otherwise divergent) and moreover, any series con-
tinguishes different physical systems, but the operators structed out of these non-zero elements converges abso-
on these Hilbert spaces. lutely. The dimension of 2 (I) then is |I|, the scalar prod-
uct x|y := iI xi yi . For example, the set of reals R is
Theorem 1 (Classification of Hilbert spaces). For any pos-
uncountable, so that 2 (R) is inseparable.
sible cardinality (i. e. number of elements) of a set there
To conclude this section: In quantum mechanics we
exists up to an isomorphism precisely one Hilbert space; in
essentially deal with a single Hilbert space, the separa-
particular, two Hilbert spaces are isomorphic, if and only
ble, infinite-dimensional Hilbert spacethough it is not
if their dimensions coincide.7
the Hilbert space itself, but rather the structure of opera-
The isomorphism concept can be understood as in- tors on this space which distinguishes different physical
distinguishable by inner structure, i. e. by Hilbert space situations.
operations only; in the well-known setting of square-
integrable functions we may always think of all func-
tions, some of which lie inside Hilbert space and others 3 Spectral theory
outside (are non-normalisable), but in a pure Hilbert-
space setting such considerations are not allowed. For a Spectral theory most prominently deals with the general-
positive integer d, the Hilbert space Cd of column vec- isation of the spectral theorem from linear algebrathe
tors with d complex entries is essentially the only Hilbert diagonalisation of hermitian (or normal) matricesto
space with dim H = d. A Hilbert space is called separa- infinite-dimensional spaces. To understand these things,
ble, if its dimension is countable, i. e. less or equal of the a basic knowledge of measure and integration theory is
cardinality of the integers.8 Thus, up to an isomorphism necessary, which will be introduced in the first two sub-
there exists precisely one infinite-dimensional separable sections. Then we can finally state the precise meaning
Hilbert space. of the Hilbert space L2 (R).
Consider for example a single particle in one space di-
mension: the Hilbert space is the set of square-integrable
3.1 Measure theory
functions L2 (R). Now change to the Fock basis, the eigen-
states of the harmonic oscillator {|n| n N0 }, which is
Measure theory deals with the problem of associating a
a countable and infinite basis. But obviously we have
measure to certain sets.9 Measures can be thought of the
by this an isomorphism to the Hilbert space 2 (N0 ) of
length of a distance, the area of a surface or the volume of
square-integrable sequences. Note that this is still a ba-
some space. Thus, given a set (think of Rn ), one could
sis regardless of the potential (though not necessarily an
envision a function : P() [0; ] (where P() is the
eigenbasis), so that L2 (R) is separable. Further, finite or
power set, the set of all subsets of ) which maps to each
countable unions and cartesian products of countable
set its volumewhich is non-negative. However, there
sets are still countable; thus direct sums and tensor prod-
are certain pitfalls, which are best illustrated by the fol-
ucts of finitely and countably many separable Hilbert
lowing paradox (in mathematics, this is related to the ax-
spaces are separable.
iom of choice).
Although inseparable Hilbert spaces are not so com-
mon in physics, it is very easy to construct them. To con- Theorem 2 (Banach-Tarski paradox). Let A, B Rn be
struct a Hilbert space for an arbitrary given dimension, arbitrary sets with non-empty interior. Then, there ex-
choose an arbitrary index set I of that cardinality and let ist countably many sets A1 , A2 , . . . and rigid mo-
tions10 m1 , m2 , . . . , such that A = nN An and B =
2 (I) := (xi )iI CI |xi |2 < . (5) nN mn (An ), where both decompositions are disjoint, i. e.
iI
Ai Aj = and mi (Ai ) mj (Aj ) = for i = j. For A, B
The sum of possibly uncountably many terms is to be Rn bounded and n 3, this is even possible with finitely
understood in the following sense of summability: it many sets and rigid motions.
is defined only if at most countably many xi are non-
7 The proof is rather simple, it essentially reads Map one basis bi- 9 Measure theory is not to be confused with the theory of mea-
jectively onto another. surements in quantum physics.
8 This notion of separability is completely unrelated to the same 10 These are bijective mappings m on Rn which preserve
i
term from entanglement theory. Euclidean distances, i. e. d(mi (x), mi (y)) = d(x, y).
C 2015 WILEY-VCH Verlag GmbH & Co. KGaA, Weinheim Wiley Online Library 647
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K. S. Ranade: Functional analysis and quantum mechanicsan introduction
Progress
Review Paper
of Physics
It is actually possible to cut a sphere in just five are orthogonal (these measures will be used in the
parts, which can be reassembled to two spheres both spectral theorem below).
of the same size as the original sphere. To avoid such
seemingly absurd effects, one restricts the measure func-
tion to a class of measurable sets
and calls (,
) 3.2 Integration theory
a measurable space, if
P() forms a -algebra. A
-algebra must fulfil three conditions: (i) it contains the Usually while learning mathematics in school one starts
basic set:
, (ii) it contains every complement: A with the Riemann integral of a function. The preimage
\ A
and (iii) it contains countable(!) unions: [a, b] of a bounded function to be integrated, e. g. f :
A1 , A2 ,
nN An
. [a, b] R is partitioned into smaller and smaller inter-
A measure now is a function :
[0; ], which vals, and the limit of upper and lower sums, if they both
maps to each measurable set a non-negative number exist and coincide, is called the Riemann integral of f . We
or infinity and fulfils the following axioms: (i) () = 0 shall now introduce the Lebesgue integral.
and (ii) for countably many disjoint sets (An )nN there The guiding principle of the Lebesgue integral is to
holds -additivity: ( n=1 An ) = n=1 (An ). The triple partition the image instead of the preimage space. For
(,
, ) is called a measure space. a measurable set M the characteristic function (or
Examples of measures are: indicator function) M is defined by M (x) = 1, if x
M, and zero otherwise. The integral for such a func-
r
the counting measure | | on arbitrary sets, i. e. the car- tion is then defined as M (x) d(x) := (M) and for
n
dinality (number of elements) of a set; a step function f (x) = i=1 ai Ai (x) with positive ai ac-
r
the Lebesgue measure on Rn is defined by
cordingly by f (x) d(x) := ni=1 ai (Ai ). For a general
[a1 ; b1 ] [an ; bn ] = ni=1 (bi ai ) and ex- non-negative function f the integral is defined by ap-
tending it (as a so-called regular measure) to other proximation from below as the supremum of all non-
Lebesgue-measurable sets by exhaustion. negative step functions majorised by f . General real-
valued functions are split into positive and negative part
The Lebesgue measure is very important, and the set by f = f+ f with f (x) := max f (x), 0 ), and the inte-
of measurable sets is very large; it is rather difficult to find gral is given by f := f+ f , if both parts exist sep-
a set which is not measurable (indeed, without invoking arately; complex-valued functions are further split into
the axiom of choice, it is not possible to construct a non- real an imaginary part.
measurable set). Important are null sets, i. e. sets of mea-
sure zero and their subsets; a property is said to hold al- Theorem 3 (Riemann-integrable functions). A bounded
most everywhere, if it holds everywhere with the possible function f : [a; b] R is integrable in the sense of
exception of a nullset. Finally, note that every countable Riemann, if and only if the set of discontinuities has van-
set is a Lebesgue nullset, but not vice versa (e. g. the Can- ishing Lebesgue measure.
tor set). An example of a function, which is integrable accord-
Measures for which there hold () = 1 are called ing to Lebesgue, but not in the sense of Riemann, is the
probability measures and are the foundation of Kolmogo- Dirichlet function Q on R. However, there may exist
roffs probability theory. There are some generalisations improper integrals in the Riemann sense for functions
of the notion of a measure to be informally mentioned which do not possess a Lebesgue integral, e. g. sinc(x) =
here: for a signed measure, the measure of a set may be sin x
on R; here, positive and negative part diverge, but
x
negative (in R), and for a complex measure, the measure the limit x is possible (compare the conditionally
of a set may be complex (in C). More important in quan- convergent series an := (1)
n
).
n
tum physics, in particular in quantum information, are
operator-valued measures, where the measure of a set is Definition 3 (Lp spaces). For p [1; )
p and a measur-
not a number, but an operator on a Hilbert space: able functions f , define f p := [ f (x) d)]1/p . The set
Lp(,
, ) is the set of functions f : C, for which
r a positive operator-valued measure (POVM) maps f is finite. If N (,
, ) denotes the set of all func-
p
a set to a positive operator, such that () = 1 tions which are zero almost everywhere (in the sense men-
(this may be thought of as a generalised probability tioned above), we can identify two functions f and g,
measure); if f g N (,
, ). The set of equivalence classes of
r a spectral measure is a POVM with the additional functions which are identical almost everywhere is the set
property that E1 E2 = implies that (E1 ) and (E2 ) Lp (,
, ) := Lp (,
, )/N (,
, ).
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Fortschritte
der Physik
Fortschr. Phys. 63, No. 910 (2015)
Progress
Review Paper
of Physics
C 2015 WILEY-VCH Verlag GmbH & Co. KGaA, Weinheim Wiley Online Library 649
Fortschritte
der Physik
K. S. Ranade: Functional analysis and quantum mechanicsan introduction
Progress
Review Paper
of Physics
f : R be a measurable function. The Hilbert space On this set, the resolvent (mapping) is RA () := (1
again is L2 () := L2 (,
, ). A)1 . The spectrum (A) := C \ (A) is the complement
We can define a multiplication operator Af : D(Af ) of the resolvent set; it is closed and can be separated into
H by (Af g)(x) := f (x) g(x) on the domain D(Af ) := three disjoint parts:
g L2 ()| f g L2 () . Obviously, this is the largest
1. the point spectrum: 1 A is non-injective (i. e. there
possible domain of definition for Af , since we require the
are eigenvectors);
image of Af to lie in L2 (). It can be shown that this op-
2. the continuous spectrum: 1 A is injective, but not
erator is selfadjoint with D(A ) = D(A), and the spectral
surjective, and possesses a dense image;
theorem will tell us, that every selfadjoint operator can
3. the residual spectrum: 1 A is injective, but not sur-
be written in this fashion. One example for such an oper-
jective and its image is not dense.
ator is the position operator x.
The residual spectrum of a selfadjoint operator is
empty, but e. g. zero is in the residual spectrum of the
3.5 Extensions of operators raising operator a+ . The spectrum of the lowering opera-
tor a is C and a pure point spectrum (cf. coherent states).
Sometimes, for non-selfadjoint operators, there exist The principal property of selfadjoint operators is that
selfadjoint extensions. An operator B is called an exten- for these the spectral theorem holds, the diagonalisa-
sion of another operator A, if D(A) D(B) and A = B|D(A) tion of operators. There are several forms of the spectral
(B restricted to the domain of A); this is usually denoted theorem, but we shall discuss only two of them. Let
as A B. The question of whether selfadjoint extensions A be a selfadjoint operator on an appropriate domain
exist, is answered by the theory of defect indices. Let z D(A):11
be arbitrary complex numbers with positive and nega-
1. There exists a measure space (,
, ), a measurable
tive imaginary part, respectively (one usually takes z =
function f : R and a unitary operator U : H
i). The defect indices areindependent of the choice
L2 (), such that (i) x D(A) f Ux L2 () and (ii)
of z given by n := dim D(A )| A = z N0 .
UAU = f for L2 () with some f L2 ().
An operator is selfadjoint, if and only if n+ = n = 0;
2. There exists a unique spectral measure E :
B(H)
there exist selfadjoint extensions, if and only if n+ =
(i.e. the bounded operators on H) such that y|Ax =
n > 0, but not otherwise.
R dy|E x for x D(A) and y H; here, a spec-
A semibounded operator is an operator which ful-
tral measure is a mapping from subsets of R (the
fils v|Av C v2 (and therefore is hermitian) for all
so-called Borel- -algebra), where EA are orthogonal
v D(A) (or, similarly ). These operators possess self-
projections, E = 0, ER = 1 and for pairwise disjoint
adjoint extensions with the same constant C (Friedrichs
A1 , A2 , . . .
there holds
i=1 EAi = E i=1 Ai point-
extension). Note that Hamiltonian operators are usually
wise.
semibounded because there should exist a ground-state
energy. The first version informally says that every selfadjoint
operator can be understood as multiplication operator
on some Hilbert space. The second version allows us to
3.6 Spectral theorem apply a measurable function f : R R to A: in the spec-
tral integral replace by f (), i. e. R f () dy|E x.
For a matrix A, the spectrum is the set of eigenvalues, and
C is an eigenvalue of A, if and only if det(1 A) = 0,
i. e., if 1 A is not invertible. For operators on infinite- 4 Distributions
dimensional Hilbert spaces, there are different classes of
non-invertibility defining different parts of the spec- In classical physics concepts like point charges
trum. We shall start with the complement of the spec- ( r ) = q ( r ) in electrodynamics, line and area charges,
trum, the resolvent set. For an operator A : D(A) H the currents etc. are commonly used. In quantum mechan-
resolvent set is defined by ics the eigenstates of the position operator x (in position
11 This and related statements usually also hold for normal oper-
(A) := C| 1 A : D(A) H is bijective and
ators, i. e. operators N, for which NN = N N, but where the
(1 A)1 is bounded . (9) spectrum does not need to be real.
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representation) are said to be delta functions, because vice versa, for every T H there exists some , such that
x(x) = x(x), those of the momentum operator p = i x T = T .
ikx
plane waves e . In both cases, these eigenfunctions are
non-normalisable or not even true functions and thus
To each element of a Hilbert space there is associated
lie outside of the Hilbert space H = L2 (R). Nevertheless,
a unique element of its dual and vice versa, i. e. there is
one regularly writes for position and momentum the
some type of symmetry between H and H ; they are iso-
equalities
morphic, H = H , and of the same size.
In case of the Hilbert space L2 (R), the explicit form
|xx| dx = |pp| dp = 1H (10)
xR pR
of the functional Tf is f (x) (x) dx. Now, if we
choose a subset Hlimiting the elements allowed
and in the domain of definition, the number of admissible
functionals increases. The space is in general not
x |xx| dx = x, p |pp| dp = p, (11) a Hilbert space any more, and not all functionals can be
xR pR
written in the form of an integral. By an appropriately
which do work well in calculations. Similarly, for a limited choice of (the test functions), we get a very
potential well V ( r ), one usually distinguishes between large set (the distributions, which test the test
bound discrete and free continuous eigenstates and functions). A second aspect is that the functionals in
often writes the identities need to be continuous; (sequential) continuity of f
is the property that x x0 in implies f (x) f (x0 )
|EE| dE = 1H and E|EE| dE = H. (12) in C. If one would like to have many continuous func-
tionals, there must be not too many convergent series
But how to mathematically understand these things? In in . This will be achieved by an appropriate notion of
the 1930s Dirac postulated a delta function with the continuity.
property that (x) = 0 for x = 0, but (x) dx = 1; for Before going into details, we shall give an overview on
some other function f , this implies f (x)(x) dx = f (0). various mathematical structures in functional analysis in
It is obvious that strictly speaking no such func- the following in Table 1; usually a set with some function
tion can exist, but the concept is nevertheless has a specific name (such as Hilbert space).
very useful in physics. The mathematical theory of For the details we must refer to the usual textbooks,
such objects as the delta function is the theory of but we give some notes here:
distributions (or generalised functions), which was devel-
oped already in the 1940s by S. L. Sobolev and Laurent
Schwartz.
1. A structure in an upper row induces a structure in
a lower below; there sometimes is the possibility to
go from a lower row to a higher one (parallelogram
4.1 Introduction
equality, metrisability).
2. Scalar products and norms need a vector space in or-
The basic idea of distributions in mathematics is, not
der to be defined, metrics and topologies can be de-
to consider the delta function and similar objects as
fined on sets in general.
functions but as functionalsobjects mapping vectors
3. Weakening the axioms of a scalar product yields no-
to scalars, as e. g. the delta function mapping the func-
tions of bilinear and sesquilinear forms; without defi-
tion f to a complex number f (0); in physics one would
niteness norms and metrics become semi-norms and
say that a delta function is defined only inside an inte-
semi-metrics. (Note that the term metric is used in a
gral. Mathematically, one can give a one-sentence defini-
different fashion in differential geometry.)
tion of distributions: they are the continuous linear func-
4. Completeness is a notion in metric spaces (because
tionals on the space of test functions. Before explaining
of Cauchy sequences). In topological spaces other no-
these terms in detail, we shall rephrase the Riesz-Frechet
tions of convergence (net or filter convergence, which
theorem in a slightly different fashion.
are equivalent) can be used.
Theorem 5 (Riesz-Frechet theorem). Let H be a Hilbert 5. Characteristic notions for Hilbert spaces are orthogo-
space and let H be its dual, i. e. the set of continuous lin- nality, for normed spaces duality (algebraic, topolog-
ear functionals H C. For every H, the functional ical), for metric spaces sequences, Cauchy sequences
T : H C with T () = | is an element of H , and, etc.
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K. S. Ranade: Functional analysis and quantum mechanicsan introduction
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4.3 Test functions and distributions 12 I. e., the functions must be exactly zero, not just approaching
zero. In complex analysis, this is not possible for holomorphic
We shall start by defining a certain class of functions, the functions C C because of the identity theorem, except for
so-called test functions. To this aim, consider an open set 0.
Rn . The support of a function f is the closure of the 13 D is a shorthand notation for derivatives: for a function
set, where f does not vanish: supp f := x | f (x) = 0 . f : Rn C higher-order and higher-dimensional derivatives
Further, define by C k () the set of functions which are are written in by a multi-index = (1 , . . . , n ) Nn0 : there
1 n
k times differentiable with a continuous derivative holds D f := x 1 . . .
xnn
f , and || := 1 + + n is
1
(where k may be infinite). The test functions now are the called the order of .
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so for all D(); the set D () is then complete (in the 4.6 Tempered distributions and the Fourier transform
sense of sequences).
For test functions (or more generally for L1 and L2 func-
tions) on Rn one can define the Fourier transform. To de-
4.4 Structure of distributions fine the Fourier transform for distributions, note that for
L2 (Rn ) functions, there holds
The set of distributions D () obviously is a vector space.
Moreover, every distribution can be multiplied with a (Ff )(x)g(x) dx = f (x)(Fg)(x) dx, (15)
C -function f : (f T )() := T (f ), D(), but two dis-
tributions cannot be multiplied.14 It is also possible to and one can, in the same spirit as in the case of deriva-
define the convolution of two distributions, and distri- tives, try to define the Fourier transform by acting on the
butions can be approximated by C -functions (e. g. the test function. However, F is never a test function, except
delta distribution by Gaussians). for 0. Therefore, it is necessary to enlarge the space of
Distributions can be differentiated arbitrarily: in test functions, which results in a smaller dual. The space
analogy to the product rule for a C 1 (R) functions, f = which one considers is known as the space of rapidly de-
f (the boundary terms vanish), on defines the creasing functions (or Schwartz functions):
derivative of a distribution T by T () := T ( ). Higher-
order and higher-dimensional derivatives are accord- S(Rn ) := f : Rn C| f C (Rn ),
ingly defined by (D T )() := (1)|| T (D ).
(, N0 ) lim x D f (x) = 0 . (16)
n
4.5 Sobolev spaces These are the functions which are arbitrarily often dif-
ferentiable and go to zero faster than every polynomial,
Given a differentiable function f and any D(), there and their derivatives should do the same. Here the stan-
holds that f = f (the boundary terms are zero). dard example is a Gaussian (x) = exp( x), > 0. The
Even if f is non-differentiable, there may exist some important property with respect to Fourier transforms
function g, such that f = g for all D(). In is that F(S(Rn )) S(Rn ). There holds D(Rn ) S(Rn ) and
contrast to the common (strong) derivative, g is called the thus S (Rn ) D (Rn ) we shall not mention the topology
weak derivative of f . The derivative in the sense of dis- here. The space S (Rn ) is called the space of tempered dis-
tributions is still weaker. Altogether there are three no- tributions.
tions of derivatives: the common (strong), the weak and The Fourier transform now is defined by (FT )() :=
the distributional derivative. T (F). There holds e. g. (FD() T )() = (i/)|| x FT ,
F = exp[ i ax]/(2)n/2 and F1 = (2)n/2 0 (in Rn ),
Example 1 (Derivatives). The absolute-value function where a is the delta function at some point a Rn , i. e.
| | : R R is continuous for x = 0, but not differentiable.
a (x) = (x a). For a polynomial f (x) = nk=1 ak xk there
Nevertheless, there is a weak derivative, the sign function n
follows (Ff )(p) = k=1 ak ( i p k
) . There is a regularisa-
sgn, which is +1 for x > 0, 0 for x = 0 and 1 for x < 0. tion of distributions: for f S (Rn ) there exists a function
This function does not possess a weak derivative, but 2 is g and some Nn0 , such that f = D g.
its derivative as a distribution.
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c C (Rn ) being smooth functions and the linear par- 5 Further topics
tial differential equation Lu = f with f D (Rn ). We look
for a fundamental solution for L, i. e. a distribution E, for In this final section of this tutorial, we discuss some fur-
which there holds LE = . If this E is known, u := f E ther topics from functional analysis and also from alge-
solves the original equation, because of Lu = L(f E) = bra. However, a fully rigorous treatment of these topics
f LE = f = f ; note that this is essentially the method requires in general much more terminology and nota-
of Greens functions. In particular, the delta function is tion, which would render it too long for this introductory
the identity with respect to the convolution. text. Nevertheless, we want to include these topics in or-
The standard example is the Poisson equation from der to show that mathematics has many aspects relevant
electrostatics: ( r ) = 4( r ). A fundamental solution to physics, which are somewhat less known to physicists.
r )
of the Laplacian is E = 41|r | and ( r ) = |( r r |
d r .
(Note that for convolutions there holds Tf1 Tf2 = Tf1 f2 )
The basic idea is to use the Fourier transform: E = 5.1 Operator algebras
becomes (x2 y 2 z2 ) FE = r 2 FE = 1 with r =
x2 + y 2 + z2 , so FE = 1/ r 2 ; the inverse transform of Operator algebras in some sense make abstract the no-
1/ r 2 is 1/(4r) which gives the desired result. tions of operators on a Hilbert space. The theory of op-
erator algebras is relevant to physics, since there is quite
a lot of mathematics literature dealing with topics from
4.7.2 Rigged Hilbert spaces quantum mechanics, but in general, difficult to read for
physicists.
At the end of this chapter, we would like to mention The term operator is as before a linear mapping on a
that there indeed exists a possibility to mathematically Hilbert space. The term algebra appears in two notions:
explain generalised eigenfunctions of position and mo- on the one hand as the name of a mathematical field of
mentum and of other operators, although this is rather the study of algebraic structures such as groups, rings,
complicated. Note first, that in the continuous spec- fields etc., on the other handas we use it hereas
trum of a selfadjoint (or more generally normal) oper- one of these algebraic structures, which can informally
ator there a no true eigenfunctions, but approximate be described as a vector space with multiplication.
eigenfunctions. Axiomatically, it is a quadruple (V, K , +, ) consisting
of a vector space V over a scalar field K , on which
Theorem 6 (Approximate eigenvectors). Let T be a
there is additionally defined a multiplication of two
bounded selfadjoint operator on H and (T ). Then,
vectors : V V which fulfils the following conditions
there exists a sequence (xn )nN in H with xn = 1 for all
(for all a, b, c V and K ); as is customary, we
n N, such that limn (1 T )xn = 0.
suppress the multiplication symbol:
For example, in case of the position operator consider
Gaussians of decreasing width approach a delta function 1. associativity: (ab)c = a(bc);15
(up to normalisation). 2. distributivity: a(b + c) = ab + ac and (a + b)c = ac +
For a generalised version of the spectral theorem one bc;
must choose a space on which there is defined a scalar 3. scalar multiplicativity: (ab) = (a)b = a(b).
product and which additionally is nuclear (a property The algebra is commutative, if there holds ab = ba,
which cannot be explained here); possible choices for and it is called unital (or algebra with identity) if there is a
are the test functions or the Schwartz functions. The neutral element e V , such that there holds ae = ea = a.
completion of is a Hilbert space H and dual of is The principal examples of such algebras are n n
. With the appropriate embeddings, the triplet matrices Mn (K ) over a field K . Moreover, the bounded
H is called rigged Hilbert space or Gelfand triplet. linear operators on a Hilbert space H, written as B(H) (or
There holds the Gelfand-Kostyuchenko theorem [1, 8, 9], L(H)) form such an algebra as well as their subalgebras,
which we cannot give in rigorous form here. But infor-
mally spoken, it states that for an operator T under cer-
tain assumptions, there exist enough generalised eigen- 15 Note that in Lie theory a Lie algebra with Lie bracket [ , ] :
vectors |x , such that we may write 1 = |x x | d V V V is in general non-associative, and algebras in
and T = |x x | d . Note that these operators can- our sense are called associative algebras there. (The Lie bracket
not act on the whole Hilbert space, but only on the can be thought of an abstract version of the commutator of
subset . operators.)
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like block matrices. Commutative algebras are e. g. the Cauchy sequence), but weakly: for every bra-vector |,
set of diagonal matrices or continuous functions C[a; b] |n converges to zero.
on an interval or more generally on a compact set. An al- Given a sequence not of vectors but of operators,
gebra which does not possess an identity is the continu- there are even more notions of convergence; we shall
ous functions on an interval vanishing at the boundary consider only the three most important. Let (An )nN be a
C0 [a; b]. sequence in B(H), the bounded operators, and A B(H)
An involution is a function : A A on an algebra A be an operator.
fulfilling
1. The sequence (An )nN converges in the norm (or uni-
1. involutivity: x = x; formly) to A, if limn An A = 0 in R. Here, A is
2. anti-linearity: (x + y) = x + y ; the as usual operator norm of eq. (6).
3. anti-multiplicativity (xy) = y x . 2. It converges strongly (more precisely: with respect to
the strong operator topology) to x, if for every x
An involutive algebra is an algebra with an involution.
H, the sequence (Axn )nN in H converges strongly to
In mathematics, usually a star is used instead of a dag-
Ax H.
ger (A instead of A ), and such algebras are also called
3. It converges weakly (more precisely: with respect to
-algebra; this is the star in C -algebra. The standard ex-
the weak operator topology) to x, if for every x H, the
ample of involutive algebras are complex square matri-
sequence (Axn )nN in H converges weakly to Ax H.
ces or bounded operators with their adjoints, i. e the
transposed and complex conjugated matrix. The guid- Convergence in the norm implies strong, and this im-
ing idea is to make terminology from spectral theory ab- plies weak convergence. To give counterexamples for the
stract, i. e. to characterise them by their inner properties. opposite, consider An := |nn| and Bn := |n0|. Both se-
The topic of operator algebras is connected to func- quences do not converge in the norm, but weakly to the
tional analysis by normed algebras, i. e. algebras with a null operator; the first one does so also strongly, the lat-
norm. A Banach algebra (similarly
to a Banach
space) is ter does not. In the mathematical-physics literature there
a normed algebra, where xy x y for all x, y A; often appear notions for which we shall give just the def-
this condition implies continuity of the multiplication. initions, in order that the reader may grasp the idea, if he
If there holds the
(at first sight somewhat odd-looking) finds them somewhere (usually it is always good to think
condition x x = x2 , the algebra is called C -algebra. of square matrices):
(Using the operator norm this holds e. g. for square
1. A C -algebra is a a norm-closed involutive subalgebra
matrices.)
of B(H);
2. a von-Neumann algebra is a strongly (or equivalently
weakly) closed involutive subalgebra of B(H).
5.2 Notions of convergence
It can be shown that every C -algebra in this sense ful-
In the preceding sections we already have mentioned the fils the C -property from above. The finite-dimensional
possibility to use different notions of convergence. Here C -algebraswhich always contain the identityare
we should consider in more detail some notions of con- easy to classify; they are the direct sums of simple
vergence one usually encounters in mathematics litera- C -algebras, which again are the full matrix algebras
ture. Let (xn )nN be a sequence and x be an element in Mn (C) of complex n n-matrices.
some Hilbert space H: The commutant of a set M B(H) is the subalge-
bra M := {A B(H)| (B M)(AB = BA)} of all elements
1. The sequence (xn )nN converges strongly or in the
in B(H) commuting with every element in M (the nota-
norm to x, if limn xn x = 0 in R.
tion should not be confused with the dual); for exam-
2. It converges weakly to x, if for every y H the se-
ple, as an instance of Schurs lemma, if A = Mn (C), then
quence y|xn x converges to zero in C.
A = C1. The bicommutant theorem says that M is a von-
In case of doubt, on usually takes strong conver- Neumann algebra, if and only if M = M . von-Neumann
gence; more generally, weak convergence can be defined algebras can be decomposed into so-called factors (of
on normed vector spaces and their dual. Strong conver- types In , I , II1 , II and III), where a factor is defined
gence implies weak, but in infinite-dimensional spaces by M M = C1.
not vice versa: consider an infinite-dimensional Hilbert Coming back to quantum mechanics: the postulates
space, e. g. Fock space {|0, |1, |2, . . . }, and a sequence of quantum mechanics say that there is a Hamiltonian
xn = |n. This does not converge strongly (e. g. it is not a operator H, which generates the dynamics of a state
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K. S. Ranade: Functional analysis and quantum mechanicsan introduction
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Fortschr. Phys. 63, No. 910 (2015)
Progress
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relations eitAi eisAj = eisAj eitAi and eitBi eisBj = eisBj eitBi and the mathematical sense. However, not all mathematical
states can be described this way, and the notion there is
eitAi eisBj = eistij eisBj eitAi somewhat more general, but under some continuity as-
sumptions, the converse also holds.
are fulfilled. If the operators act irreducibly16 on H, The states moreover form a convex and compact
then there exists a unitary mapping U : H L2 (Rn ), set. Within these sets there exist extremal points, i. e.
unique up to a phase ei , such that UeitAi U = eit xi and points which cannot be written as true convex combi-
UeitBj U = eit pj where xi = xi and pj = i x i are the usual nations of other states. Formally: a state is extremal, if
position and momentum operators on Rn . from = 1 + 2 with , > 0 and + = 1, it fol-
The intuitive reason behind this is that the Heisen- lows that 1 = 2 = . Extremal points in the states space
berg commutators exhibit the local properties (at every are the pure states, other states are mixed states. Accord-
point x), but not the global ones. The Weyl commutators ing to the Krein-Milman theorem, a convex and com-
take into account global properties; remember that the pact set (such as the states) is the closed convex span of
exponentiated operators are translations of momentum its extremal states. For a two-dimensional Hilbert spaces
and position, respectively, and thus connect different this is very well illustrated by the Bloch sphere. The in-
pointsin the case of the particle in a box, one would finitely many points on the surface correspond to the
hit the wall if the shift distance is too large. (This is pure states, the convex hull (the interior) to the mixed
related to the theory of Lie groups and Lie algebras.) states. (One can compare the example of a probabil-
ity distribution with finitely many outcomes: there the
extremal points are the probability distributions with
5.6 Mathematical structure of quantum mechanics
one certain outcome.).
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K. S. Ranade: Functional analysis and quantum mechanicsan introduction
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Review Paper
of Physics
physics and quantum mechanics, but to give the reader M. Gelfand, Collected papers, Vol. I (Springer 1987),
examples of mathematical thinking in a language appro- 505509.
priate for physicists. In this spirit we discussed some top- [8] I. M. Gelfand and N. J. Wilenkin, Verallgemeinerte
Funktionen (Distributionen) Vol. IV (VEB Deutscher
ics of functional analysis which are relevant for physics.
Verlag der Wissenschaften, 1964).
It is clear that there is a vast amount of mathematical [9] G. G. Gould, J. London Math. Soc. 43, 745754
knowledge relevant to quantum mechanics and physics (1968).
in general, but which is unfortunately not so widely [10] F. Schwabl, Quantenmechanik (Springer, 6th ed.,
known by physicists. 2002).
[11] J. von Neumann, Mathematische Grundlagen der
Key words. Functional analysis, quantum mechanics, tutorial. Quantenmechanik (Springer, 1932).
[12] F. Scheck, Theoretische Physik 2 (Springer 2nd ed.,
2006).
References [13] B. C. Hall, Quantum Theory for Mathematicians
(Springer, 2013).
[1] D. Werner, Funktionalanalysis (Springer 5th ed., 2005). [14] E. Schmidt, Math. Ann. 63, 433476 (1907).
[2] M. Reed and B. Simon, Methods of modern mathe- [15] E. Schrodinger, Proc. Cambridge Phil. Soc. 31, 555563
matical physics, Vol. I: Functional Analysis (Revised (1935), and 32, 446452 (1936).
and enlarged edition 1980), Vol. II: Fourier Analysis, [16] K. Kraus, States, effects, and operations (Springer,
Self-Adjointness (1975). 1983).
[3] J. B. Conway, A Course in Functional Analysis [17] W. F. Stinespring, Proc. Amer. Math. Soc. 6, 211216
(Springer 2nd ed., 1990). (1955).
[4] F. Gieres, Reports on Progress in Physics, 63, 18931931 [18] E. Strmer, J. Funct. Anal. 3, 4868 (1969).
(2000). [19] R. L. Hudson and G. R. Moody, Z. Wahrschein-
[5] G. Bonneau, J. Faraut, and G. Valent, American Journal lichkeitstheorie verw. Gebiete 33, 343351
of Physics 69, 322331 (2001). (1976).
[6] J. Elstrodt, Ma- und Integrationstheorie (Springer 4th [20] C. M. Caves, C. A. Fuchs, and R. Schack, J. Math. Phys.
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Nauk SSSR 103, 349352 (1955), translated in Izrail 11031106 (1988).
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