Our aim is to provide a broad picture which is self-contained. For this reason we provide intuitive justification of what is being done. Technical details are often not presented.
The first step taken by Landau in setting up his phenomenological model for the Free Energy was to introduce the idea of an “order parameter” for the system. The order parameter was to be zero when the ground state of the system did not break the symmetry of its Hamiltonian and was to be non-zero if the ground state broke the symmetry of the Hamiltonian. It was thus a measure of the “order” present in the system. Thus a zero value for the order parameter meant that the symmetry of the ground state was the same as the symmetry of the Hamiltonian while a non-zero value meant that symmetry breaking had occurred. A simple example illustrating this idea is provided by a model for ferromagnetism. A ferromagnetic system can be modeled by a Hamiltonian made out of elementary magnets which are placed at lattice sites. The elementary magnets interact in a rotationally invariant way. The Hamiltonian is thus rotationally invariant. The order parameter is taken to be the average magnetisation density. When this magnetisation is zero the ground state is not ferromagnetic and is rotationally invariant. When the magnetisation density is non-zero we have a ferromagnet which has directionality and is thus not rotationally invariant and breaks the rotational symmetry of the Hamiltonian. We have spontaneous symmetry breaking.
The next key idea introduced by Landau was to suppose that the order parameter was a smooth function of the external macroscopic parameters (such as the temperature and pressure) in the neighbourhood of a symmetry breaking transition. Such transitions are called second order phase transitions. For such transitions even though the symmetry changes abruptly for certain critical values of, say the temperature, the order parameter does not change abruptly but is assumed to change smoothly from a non-zero value to zero. This also means that near a symmetry breaking transition the order parameter is small. Noting this fact Landau supposed that the Free Energy, near a phase transition, was a low order polynomial function of the order parameter.Instead of an arbitrary function of the order parameter the Free Energy was now reduced to be a low order polynomial in the order parameter. The coefficients of this Landau polynomial were taken to be smooth functions of the external macroscopic parameters.
Determining equilibrium configurations for a system is thus reduced to the technical problem of determining the minima of the Free Energy. This in general is a difficult problem. The problem can be simplified by restricting the Free Energy, near a phase transition, to be quartic polynomials in the order parameter. This is reasonable as the order parameter is expected to be small near a transition point. Even after this simplification, for a general order parameter with group transformation properties, the problem is not easy. What we will show is that general qualitative features of the system can be found without ever actually finding these solutions! This is done by combining group theory methods with topological ideas. Such an approach does not give the exact functional form for the order parameter but gives the allowed symmetry breaking patterns the system can have. By a symmetry breaking pattern we mean that associated with a minimum state of a certain symmetry there must be saddle points and maxima with prescribed symmetries.Thus the qualitative shape of the allowed equilibrium configurations for Free Energy surface are determined by the approach.
Landau Theory: Topological and Group Theoretical Ideas
We can proceed to set up a general framework for Landau theory. Let us again summarise what needs to be done: First we need to model the physical space corresponding to the system and then we need to model the specific order associated with symmetry of the system. Physical space could be taken, for instance, to be a smooth three dimensional manifold when we are modelling a high energy systems or it could be taken to be a lattice of points when we are modelling a crystal.
The second feature needed is to give a simple description of the specific physical variables relevant for describing the physical system of interest. Thus for a magnetic system a natural choice was to introduce elementary magnets at lattice points. We might further simplify the model by assuming that elementary magnet at all lattice sites are the same. Classically such a elementary magnetic system in three dimensions can can be thought of as a collection of spin vectors (the elementary magnets), each located at a lattice site, of fixed length pointing in a certain direction of three dimensional space.The thermodynamic average of these spins then gives the magnetisation. This overall average is a natural macroscopic system order parameter while the spin at a lattice site can be taken to be a local order parameter. In this case the local order parameter can be described as a point on the surface of a sphere. The radius of the sphere represents the spin length while the join of the point on the sphere to the centre of the sphere gives the spin direction. Thus to describe this system we find we need a lattice, representing the crystal, and we need to introduce an order parameter space at each lattice point to describe the spin. The classical order parameter space we found was the surface of a sphere. We turn to the general situation of a system with group symmetry.
For a system with group symmetry we will take the order parameter to be a vector and the order parameter space to be a space associated with a linear representation of the group [
8]. This immediately relates order parameter with symmetry and group theory. A linear representation of a group means that each group element is replaced by a matrix and the combination rule of the group is captured by the rules of matrix multiplication. These matrices are said to form a faithful representation of the group if the unit element of the group is uniquely represented by the diagonal unit matrix. If more than one matrix represents the unit element of the group we have a group homomorphism. If the matrices are
then the representation is said to be
n dimensional. For such a representation the matrices act on vectors which are
n dimensional. This is the vector space we choose for our order parameter space. It then allows us to consider systems which have symmetries described in terms of groups.
A group theory interpretation for the spin magnet system order parameter space we considered can be given. As we saw the order parameter space was the surface of a sphere.In terms of group theory the surface of a sphere corresponds to the coset space . This can be understood as follows: the rotational symmetry group is given by . Rotating a classical spin vector fixed at one point leads to the end point of the vector to move on the surface of a sphere as rotations do not change the length of the vector. However not all rotations change the direction of the vector. Rotations of the vector about its own axis keep it fixed. These special rotations correspond to the group . Hence points on the sphere are simply points of the coset .
We now turn to the general situation using these ideas and proceed to show how to describe the order parameter of a crystal with symmetry group G and also describe how to symmetry breaking can be formulated. This means constructing a procedure for understanding how the model approach allows the group G to abruptly change to one of its subgroups .
Let us then look at a crystal which has a certain symmetry group G, where G is a finite group of order . The order of the group is simply the number of elements present in G. The statement that the density function of the crystal is invariant under transformations belonging to the finite group G means that:
We will show how the density function, due to its invariance under
G, can be completely described as a vector with at most
components, where
is the order of the group. We also show how Landau theory constructed for this system allows us to understand why an abrupt change of the symmetry of the density function can happen. The density function change near such a transition is small and a quartic Landau polynomial for the system near a transition point is powerful enough to address symmetry breaking issues. It is also experimentally known that not all subgroups
H of a given group
G are realized,
i.e., selection rules seem to operate in these symmetry breaking transitions. Our goal is to understand this fact from a general point of view. To understand this problem we will need to use the elegant topological arguments given by Michel and Mozrzymas [
7]. The topological idea used in [
7] was topological Morse Theory.
To proceed, we need to introduce relevant ideas about topology and manifolds. We start with topology. We need to use Morse Theory. Morse Theory in its simplest form, places lower bounds on the number of critical point of index
k that a real valued function on a manifold must have in terms of numbers called Betti numbers [
9]. Betti numbers are easy to calculate and are fixed by the topological properties of the manifold. Intuitively the Betti numbers count the number of different dimensional holes present in a a manifold. Critical points of a real valued function are points where a function has a maximum, minimum or a saddle points. The index
k of a critical point tells us that in the neighbourhood of the critical point there are
k Euclidean directions in which the function decreases in value. Thus Morse theory places constraints on the number and type of maxima, minima and saddle points that a real valued function (satisfying certain conditions) on a manifold can have. By choosing the real valued function to be, for instance, the Free Energy in thermodynamics or the Energy in mechanics consequences that of these topological constraints can be explored.
Next we recall that a manifold is a space which locally looks like Euclidean space. A simple example is the map of the earth in terms of an atlas. Each map in the atlas is a local description of a part of the earth.
A n dimensional manifold thus has a local description in terms of n Euclidean coordinates and a real valued function can be written locally as . These Euclidean coordinates can be chosen in different ways. For a manifold of dimension n, if the critical point of a function is a maxima as the function decreases in value in all of its n directions while if the corresponding critical point is a minima as the function increases in all of its n directions. In between values for k represent saddle points.
The use of Morse theory in Landau theory is rather natural as there is a natural real valued function, namely the Free Energy, whose critical points, if minima, represent possible equilibrium configurations of the system [
9]. The thermodynamic Free Energy function
depends on
the temperature and pressure of the environment in which the crystal is placed and on
the density of the crystal.The equilibrium density
is determined by minimising F.
Even though appears to be a function with uncountable degrees of freedom, the fact that it is invariant under a finite group G reduces its degrees of freedom as we now demonstrate. Indeed, as we now show, its degrees of freedom are the same as those of a Euclidean vector of dimension equal to the order of the group G.The equilibrium value of a density function with finite group symmetry G is thus fixed by determining the coordinates of a dimensional vector where is the order of the group G.
Let us formulate our symmetry breaking problem in group theoretical terms and then show how group theory reduces the degrees of freedom of the density function. Consider a crystal with finite symmetry group
G for and
and symmetry group
H for
where
H is a subgroup of
G. We want to determine if all subgroup of
G are a possible “broken” symmetry group for the crystal or if selection rules operate. In view of our assumptions we write, for
T close to
,
where
is invariant under
G and
is invariant under
H. Thus is
, the symmetry group of
is
G. From group theory [
8] we know that if
G contains
elements
then a representation of
G can be constructed by regarding the group elements as matrices
which describe transformations on a set of
linearly independent functions
(characters of the group) so that
,
. We also note that the set of functions
form a basis and we have a character expansion [
8]
Thus the coefficients
can be used as a finite set of coordinates to describe
in the basis defined by the linearly independent functions
. This demonstrates the enormous simplification that comes from the fact that the density has a finite symmetry group. Furthermore we can regard the action of the group
G on
in two ways, namely
because the coordinates change under
G or because the basis functions
change under
G. For the representation of a finite group the following theorems hold [
8]
Theorem A Every representation of a finite group G is equivalent to a unitary representation.
Theorem B Every real representation of a finite group is equivalent to an orthogonal representation.
These theorems tell us that if we consider only real representations then the space of coordinates can be chosen to be an dimensional Euclidean space. A theorem in group theory tells us that the representation of the group G of dimension is reducible. This means that by suitable transformations each matrix representing a group element can be brought to a block diagonal form. The block diagonal entries can be used to represent the group: they are the irreducible representations.As a concrete example we consider a cubic crystal. This has symmetry group which has order 48. The irreducible representations of this group have dimensions 1, 2 or 3. We will use this group to illustrate the general approach of combining group theoretical and topological ideas.
First we simplify the problem by using physical arguments. We start, following Landau, by restricting ourselves to fourth order polynomials in the order parameter, drop the cubic terms and further simplify our analysis by restricting ourselves to the three dimensional irreducible representation of the group . The cubic term is dropped as we require the system to be invariant under sign change of density. The restriction to the three dimensional irreducible representation comes from the belief that the physical system settles down to a specific irreducible representation of a group and continues to be confined to the starting irreducible representations under small changes in its external environmental parameters. This means the order parameter space can be taken to be a three dimensional vector space.
These physics-based assumptions dramatically reduce the problem from one where the vector space of order parameter had dimension 48 to one where it has dimension 3! The mathematics of group theory tells us that one needs 48 bases functions(group characters) [
8] to describe the group action. However the physics-based assumption suggests that it is enough to restrict base vectors to those belonging to the irreducible representations of the group assumed to be relevant. In our example this means working with only the three dimensions irreducible representation.
We also note the Free energy being invariant under means that Here D(g) is now a three dimensional representation of and . The equilibrium density is determined by finding a three dimensional vector such that Such a vector represents a critical point of . A further physical constraint we make is to require that goes to zero at infinity—otherwise we would get an infinite value for the Free Energy. This converts the three dimensional space, topologically, to a three sphere.
Replacing the three dimensional Euclidean space by a three sphere has important consequences. It immediately leads to Morse constraints known as Morse inequalities which we now describe. Morse inequalities relate the number of critical points of index
k a real valued function with non-degenerate, isolated critical points can have to the topological properties of the manifold encoded in numbers called Betti numbers. Betti numbers represent the dimension of Homology groups of the manifold. These groups intuitively count simple topological properties. Thus
counts the number of connected pieces that make up the manifold,
counts the number of two dimensional holes present in the manifold while
counts the number of four dimensional holes present in the manifold and so on [
9]. For our case the manifold is a three sphere and the Morse inequalities are:
where
represent the number of minima,
represent the number of saddle points and
represent the number of maxima found by solving
. Recall the general
represents the number of critical points of index
k that we get by solving
. The index
k simply tells us that the real valued function whose critical points we are considering decreases in
k Euclidean directions as one moves away from the critical point of index
k. The right hand side of the Morse inequalities are fixed by topology. They are fixed by the Betti numbers
which are topological invariants of the manifold, in our case the manifold is a three sphere [
9]. The Betti numbers for a three sphere are:
. Intuitively these numbers tell us that a three sphere has one component, that it is simply connected and that it encloses a four dimensional hole. The Betti number represents the dimension of the Homology group of the manifold [
9]. The Homology groups capture topological features of a manifold in terms of groups. The study of Homology Groups is the subject matter of Algebraic Topology [
9]. A manifold of dimension
n has a maximum of
n non-vanishing Homology groups. Calculating Homology groups is relatively simple.
Morse theory thus places constraints on the pattern of critical points a real valued function with non-degenerate, isolated critical points can have. Such a function is called a Morse function. At this stage we have a link between critical points and topology. Critical points of a function such as the Free Energy determine equilibrium properties. However we are still missing the symmetry and group theory element of our problem. The symmetry features are hidden in the number of critical point present. These numbers are constrained by group theory as we will show. Once this feature is properly introduced we can tackle our symmetry breaking problem as we will see.
We continue to work away in order to use the topological information contained in the Morse inequalities in our analysis of phase transitions. As stressed the equilibrium properties of a system are related to the critical points of the Free Energy function which we have assumed to be a quartic polynomial. We now assume the Landau polynomial is a Morse function. Our next step is to introduce group theoretical ideas relevant for our problem. We have stated that this information is hidden in the number of critical points present. We need to make this link explicit.