Discrete Space-Time Wave Kernels and Trace Identities on Regular Graphs
Abstract.
We study the discrete space-time wave equation on a -regular graph associated with the affine Laplace-type operator. For the forward time-difference scheme we derive explicit formulas for the two fundamental solutions (wave kernels) in terms of discrete modified Bessel functions and the non-backtracking walk counts on thus providing a direct and explicit link between wave propagation and combinatorial graph data. Utilizing uniqueness property of the wave kernel, we prove a new trace-type formula associated to the affine Laplace-type operator on and apply it to deduce many combinatorial identities. For example, we derive a closed-form expression for evaluation of some trigonometric sums twisted by an additive character as well as evaluations of finite sums of Chebyshev polynomials twisted by binomial coefficients.
Key words and phrases:
discrete wave equation, discrete space-time wave kernels, regular graphs, graph Laplacian, non-backtracking walks, discrete Bessel functions, wave trace identities2020 Mathematics Subject Classification:
39A12, 05A19, 05C81, 33C101. Introduction and main results
The wave equation on a simple, regular graph provides a fundamental framework for studying discrete wave propagation, bridging classical continuum mechanics with discrete structures. Physically, this equation models the dynamics of vibrations in complex mechanical networks, acoustic waveguides, and quantum particles that transition across lattice structures [10, 46], where the traditional spatial derivative is replaced by the graph Laplacian operator [17, 28] or its linear perturbation [38, 42] so that the bottom of its spectrum is equal to zero. See also [16] for a study of properties of solutions of the semilinear wave equation on networks and [15, 47] for recent advances related to the wave equation on trees in continuous time.
Space-time discretization is a standard procedure in physics. An interested reader is referred to [34] and the references therein for motivation stemming from quantum gravitational considerations. More recently, discrete space-time wave equations are used in the study of graph neural networks [50] (the so called graph wave networks). The discretization of time in [50] proved to be particularly useful for numerical computations that are shown to be constantly stable. There are, of course, different possibilities for time discretization, the most common ones being the forward difference as in [9, 42], the backward difference [8, 36] or the symmetric timescale difference, see [19, 31].
1.1. Our setup
In this paper we study the (generalized) discrete space-time wave equation
| (1.1) |
on a connected, undirected -regular graph with a finite or countably infinite set of vertices . Here
is the generalization of the combinatorial Laplacian , acting on functions , by
We assume that the real parameters satisfy and the spectral-edge condition
| (1.2) |
where is the largest eigenvalue of if is finite ( if is finite and , otherwise). Trivially, (1.2) ensures non-negativity of on a finite graph. Moreover, when is -regular tree , (1.2) yields the inequality , which ensures non-negativity of on .
Furthermore, , for , denotes the forward difference operator
The generalized Laplacian specializes to Laplace-type operators studied in [4, 12, 22, 23, 38, 42] for appropriately chosen values of satisfying (1.2).
The discrete time wave kernels associated with the operator on the graph are two fundamental solutions of (1.1) satisfying the following initial conditions:
| (1.3) |
and
| (1.4) |
1.2. Main results
Our first main result is an explicit evaluation of the discrete time wave kernels on any -regular graph in terms of the combinatorial graph data and the discrete -Bessel functions. The second main result is a trace-type formula which stems from the uniqueness of the wave kernel, by identifying the discrete time spectral realization of the wave kernel with its geometric/combinatorial evaluation.
1.2.1. Wave kernels on regular graphs
Let us first introduce some notation. Fix a base vertex . For any , let be the number of non-backtracking walks of length from to , as defined in [13, Section 2.1]. For any let
For , let
| (1.5) |
where
| (1.6) |
If is vertex-transitive, let denote the number of non-backtracking walks of length from to itself without tails (meaning there is no immediate backtracking at the beginning or end of the walk, see [13, Section 2.1]). Our first main result is the following theorem.
Theorem 1.1.
Let be a -regular graph with a fixed base point . Let and be such that (1.2) holds, and set and . Then the discrete-time wave kernels and , associated with the operator and satisfying the initial conditions (1.3) and (1.4), respectively, are given for and by
| (1.7) |
| (1.8) |
where denotes the discrete -Bessel function defined by (2.1) below.
Furthermore, if (so that ) and is vertex-transitive, then for all we have
| (1.9) |
and
| (1.10) |
1.2.2. Trace-type formula on regular graphs
Trace formulas on regular graphs, motivated by the Selberg trace formula on hyperbolic spaces [43] have been extensively studied in the past 40 years, see [1, 30, 40, 48, 49]. In this paper we obtain a ”physical” pre-trace formula which is based on utilizing the uniqueness of bounded solutions to the discrete wave equation in timescale (see [44, Theorem 3.1.], or [2] and [21] for a general timescale analogue). The pre-trace formula is then refined using the explicit representation of the coefficients obtained in Lemma 2.1 to deduce the following theorem.
Theorem 1.2.
Let be a finite -regular graph on vertices with a fixed base point and let be the eigenvalues of the combinatorial Laplacian with the corresponding orthonormal eigenfunctions . Let and be such that (1.2) holds true. Then, with the notation as above, for any positive integer and any we have the following identity:
| (1.11) |
where , , is the adjacency matrix of , is the Chebyshev polynomial of the first kind and is the column vector of elements with all entries equal to , except for the entry corresponding to the vertex , which is equal to . For a column vector and , denotes the entry of corresponding to the vertex .
Moreover, if is vertex-transitive, then
| (1.12) |
Remark 1.3.
The trace-type formula (1.11) is of a similar type as Theorem C of [30], meaning that it relates the spectrum of the Laplacian to the number of non-backtracking walks on a regular graph. Our trace formula does not involve a test function; however, it applies to a larger family of operators (generalized Laplacians ). Moreover, it is of a different, ”physical” origin - it stems from the wave propagation properties, so we view it as a physical trace-type formula. An interested reader is referred to [13] for a trace formula stemming from the heat diffusion on a regular graph.
1.3. Applications
We present three applications of Theorem 1.2: to the discrete cycle on vertices, the complete graph on vertices and a -dimensional Hamming cube. In all three cases, we deduce interesting combinatorial identities.
An application to the discrete cycle on vertices yields the following two identities. For every , every positive integer , and every real number , one has
| (1.13) |
Moreover,
| (1.14) |
Trigonometric sums of the type (1.14) and (1.13) appear in many physical and combinatorial settings. For example, they arise in describing a system of coupled oscillators under acceleration [33] or in one-dimensional Ising model with nearest neighbor interactions [37, Chapter III]. In this paper, we provide another ”physical” interpretation/realization of these sums as a (pre-)trace of the wave kernel on a discrete cycle in discrete time which, in view of an explicit ”geometric” expression for the kernel, yields their explicit evaluation.
In [9, Remark 5.2], it is shown that
| (1.15) |
Hence, (1.13) and (1.14), with , coincide with the formula obtained in [14, Corollary 11] for , and in this sense generalize the combinatorial results of [24, 25, 39]. See also [35] for a physical approach to secant and cosecant sums arising from heat diffusion.
Results similar to (1.14) and (1.13) can be obtained by applying Theorem 1.2 to any circulant graph. They will be studied in a follow-up paper.
An application to the complete graph on vertices yields combinatorial identities relating Chebyshev polynomials and the discrete -Bessel functions. For example, for every real number , every , and every , we prove that
| (1.16) |
Taking in (1.16), using (1.15), and multiplying by we obtain an identity
Finally, when applying our results to the -dimensional hypercube, we deduce identities involving Chebyshev polynomials, discrete -Bessel functions and binomial coefficients. For example, Corollary 5.9 below with yields the following identity, which holds for all , , and :
where
is the -th Krawtchouk polynomial. (Recall that, by definition, for all non-negative integers such that .)
2. Preliminaries
In this section we introduce discrete Bessel functions, describe further notation needed in the sequel and prove a representation formula for the combinatorial quantities related to numbers of non-backtracking walks of length .
2.1. Discrete Bessel functions
Discrete Bessel functions are introduced in [11] and further generalized and studied in [8, 13, 20, 21, 36, 45] in discrete timescales, including forward and backward difference operators. In this paper, we use the discrete -Bessel function on the timescale associated with the forward difference operator. This function can be expressed as
| (2.1) |
for with , and . By convention, for .
We refer the interested reader to the above references for further properties of discrete Bessel functions.
2.2. Wave kernels on a -regular tree
The universal cover of any -regular graph is a -regular tree (also known as the Bethe lattice with coordination number ), which is a connected -regular graph with no cycles. We denote such a tree by . In this section, we recall the main result of [9] in which the wave kernels on are explicitly computed. Given that is distance-transitive, the kernels depend only on the radial distance from the root . The solutions and of the wave equation (1.1) satisfying the initial conditions (1.3) and (1.4) are given by
| (2.2) |
and
where and . These expressions provide the fundamental building blocks for our analysis on general -regular graphs.
2.3. Graph coverings
Recall that a graph is called a covering graph of if there exists a map
which locally preserves adjacency: for every vertex , the neighbors of are mapped bijectively onto the neighbors of in .
In particular, if is a connected -regular graph, then its universal cover is the -regular tree with covering map
see sections 5 and 6 of [18] for more details.
Fix a lift of the base vertex . The covering map preserves adjacency locally, and therefore, for every and every , the number of vertices satisfying
is equal to the number of non-backtracking walks in from to of length .
2.4. A representation formula for
The number of non-backtracking walks of length from to is a well studied object in graph theory. Its generating function was deduced in [26], the exponential generating function was deduced and studied in [5] (see also [6] for a corresponding weighted graph result and [41] for the distributional result). However, despite an extensive literature search we could not find an expression for the coefficients , though it might be folklore in graph theory. For this reason, we derive an explicit expression for the coefficients directly in terms of the adjacency operator and Chebyshev polynomials.
Recall that is the column vector of elements with zeros at all positions except at the one corresponding to , where it is equal to , and that for any column vector we denote by the entry corresponding to the vertex . With this notation, we have the following lemma.
Lemma 2.1.
Let be a finite -regular graph with adjacency matrix and a fixed root . Let be the number of non-backtracking walks of length from to . Then, for
where are Chebyshev polynomials of the first kind.
Proof.
For each , let denote the column vector whose -th component is the number of non-backtracking walks of length from to . Then
Moreover, the vectors satisfy the standard recurrence for non-backtracking walks on a -regular graph (see [13, Section 2.1]):
and, for ,
For , let denote the column vector whose -th component is . Substituting the recurrence for into the definition of and collecting terms gives
with initial values
On the other hand, using the classical recurrence relation [32, formula 8.941.1] for the Chebyshev polynomials of the first kind with , we obtain that
Moreover, since and , we have
Substituting and multiplying by yields
This proves that the sequence satisfies the recurrence
Moreover,
and
Therefore the sequences and satisfy the same second-order linear recurrence and have identical initial values. By uniqueness of solutions of the recurrence, it follows that
The proof is complete. ∎
For vertex-transitive graphs, combining Lemma 2.1 with a result of [13] yields the following formula.
Corollary 2.2.
Let be a finite vertex-transitive -regular graph. Then, for every ,
| (2.3) |
Moreover, if is also bipartite then
for all non-negative integers .
Proof.
If is bipartite, every closed walk, and hence every closed non-backtracking walk without tails, on has even length. Therefore for . Since is vertex-transitive, every diagonal entry of is the same, hence
| (2.5) |
Thus, combined with (2.3) proves the second statement. ∎
Remark 2.3.
Remark 2.4.
It is well known that formulas for the numbers of closed non-backtracking walks on regular graphs can also be obtained from the Ihara–Bass determinant formula and the spectral theory of the non-backtracking (Hashimoto) matrix; see, for example, [3, 27, 29]. The approach developed in this section is different, since it derives these quantities directly from the recurrence relation for non-backtracking walks and the resulting Chebyshev representation.
3. Proof of Theorem 1.1
Let be any -regular graph, and let denote its universal cover with the covering map . Fix a lift of the vertex . This covering map allows us to relate the wave kernels and on to the wave kernels on via
| (3.1) |
The number of vertices at distance from equals the number of non-backtracking walks of length from to in . In other words, and for exactly vertices , hence (3.1) becomes
| (3.2) |
where we write and since is fixed. Note that the sum in (3.2) is finite for each , because whenever .
We now prove equation (1.7); the proof of (1.8) is analogous. Equation (2.2) yields
Fix . For a given , the term in the above sum appears when , as well as for all such that . This means that collects contributions from walks of length that are either non-backtracking walks of length or are obtained from shorter non-backtracking walks by adding extra steps.
4. Proof of Theorem 1.2
We start by recalling that, by the spectral theorem for self-adjoint operators (see, e.g., [17, Chapter 1]), the graph Laplacian admits an orthonormal basis of eigenfunctions with the corresponding eigenvalues . Consequently,
For let us define
| (4.1) |
(Recall that, by (1.2) we have , ). We have
where we used the fact that is the eigenfunction of with the real eigenvalue . Therefore, satisfies the wave equation (1.1). Moreover, . Trivially,
hence also fulfills initial conditions (1.3). From the uniqueness of bounded solutions to the discrete wave equation in timescale (see [44, Theorem 3.1.], or [2] and [21] for a general timescale analogue) we deduce that for all .
By identifying (4.1) with (1.7) and applying the binomial theorem to the spectral side we get
for all integers . The above identity is the identity between two binomial transforms. In view of the fact that the binomial transform is an involution, applying Lemma 2.1 for and using that , we immediately deduce (1.11).
5. Applications of the trace-type formula
In this section, we apply Theorem 1.2 to three classes of finite vertex-transitive graphs: the cycle graph , the complete graph , and the -dimensional hypercube . The spectral side of the trace type formula in those three cases is known. Using Lemma 2.1 we will be able to express coefficients and in a closed form and derive interesting identities.
5.1. Cycle
For the cycle graph on vertices, the coefficients and the numbers can be obtained directly from the definition of non-backtracking walks. We label the vertices of by , . Trivially, is -regular, hence . A non-backtracking walk, once it chooses an initial direction, either clockwise or counterclockwise, is forced to continue in that direction, since the only alternative at each step would be an immediate backtracking move, which is forbidden.
Since for , the correction term in (1.5) vanishes. Thus, for every , we have
Moreover, a non-backtracking walk from to is forced to move in one of the two directions around the cycle. Hence
| (5.1) |
In particular, for , this gives the number of closed non-backtracking walks based at . Therefore, a closed non-backtracking walk returns to if and only if its length is a multiple of . In that case there are exactly two such walks, one in each direction, and no others. Together with the convention , we obtain
| (5.2) |
Note that, for , the formula (5.1) reduces exactly to (5.2); hence for all .
The following corollary gives an explicit representation of the discrete-time wave kernel on .
Corollary 5.1.
Proof.
For , Theorem 1.1 gives
Since , we have . For , by (5.1), only the indices that satisfy or contribute to the sum. Therefore,
| (5.5) |
Substituting this into the preceding identity yields (5.4).
∎
The explicit formulas obtained in Corollary 5.1 may now be combined with the Theorem 1.2 in order to derive spectral identities for the cycle graph .
Corollary 5.2.
Proof.
For the cycle graph , we have and . The normalized eigenfunctions of the combinatorial Laplacian are , , hence
Moreover, the eigenvalues of the combinatorial graph Laplacian on are , ; hence the eigenvalues of are
Let and be such that (1.2) holds. From (1.11) combined with (5.1) and (5.5), by setting we obtain (1.13). The identity (1.14) follows from the same argument with , using (5.2) in place of (5.1).
Corollary 5.3.
For every and , one has
Moreover, for every , one has
5.2. Complete graph
Let . For the complete graph we have
The adjacency matrix of is , where denotes the matrix with all entries equal to one and is the -dimensional identity matrix. The spectrum of the adjacency matrix is given by
see, for example, [17, Chapter 1].
In the following lemma we give explicit formulas for and on the complete graph in terms of the Chebyshev polynomials .
Lemma 5.4.
Let be the complete graph with vertices . Then, if and only if and equal to zero, otherwise. For we have that
| (5.6) |
where
and
| (5.7) |
Proof.
The spectral projection decomposition of the adjacency matrix is
where
are orthogonal projection matrices. Hence, for any polynomial ,
By Lemma 2.1 we have
Equation (5.6) follows by observing that
Now we deduce (5.7). Taking in (5.6) gives
Combining this with Corollary 2.2 with yields (5.7) for . For , the right-hand side of (5.7) becomes
Given that there are no closed non-backtracking walks of length in , , hence the identity (5.7) holds true for all . ∎
Using the eigenfunctions of the combinatorial Laplacian on , Lemma 5.4 yields the following identities giving closed summation formulas for sums of products of Chebyshev polynomials and discrete -Bessel functions.
Corollary 5.5.
Let . Then, for every and every real number , one has
| (5.8) |
and
| (5.9) |
Proof.
An orthonormal basis of eigenfunctions of the combinatorial Laplacian on is given by
Here corresponds to the eigenvalue , while , , correspond to the eigenvalue . Hence the eigenvalues of are
Moreover,
Substituting this into (1.11) with and yields that for every , , satisfying (1.2) and ,
Substituting the coefficients from (5.6) into this identity and simplifying gives that
| (5.10) |
For , we have . Moreover,
Since , for , it follows that
Taking in (5.10), we obtain
Taking in (5.10) and observing that , and
we obtain
Now put and . Then
Substituting these relations into the last two displayed identities gives the stated formulas valid in the range of for which satisfy (1.2). This range contains infinitely many , and hence extension to all real follows from the fact that both sides of equations (5.8) and (5.9) are polynomials in . ∎
5.3. -dimensional hypercube
Let . The -dimensional hypercube is a -regular graph with vertices. We identify its vertex set with . The eigenvalues of the combinatorial Laplacian on are , , with multiplicity . Hence the eigenvalues of are
with multiplicity .
We fix . In the following lemma, for all we explicitly compute the combinatorial quantities and .
Lemma 5.6.
Let be the -dimensional hypercube. For , let . For every ,
| (5.11) |
where is the -th Krawtchouk polynomial.
In particular, for every , the number of closed non-backtracking walks of length without tails starting at is
| (5.12) |
Proof.
For , define
Then the family is an orthonormal basis of eigenfunctions of the adjacency operator on . A direct computation shows that
where . For , by Lemma 2.1
Using the spectral decomposition of with respect to the basis , we obtain
Grouping the terms according to , we obtain
If , then equals the number of coordinates at which both and are equal to . If this number is , then there are such vectors , and in this case . Therefore
where is the -th Krawtchouk polynomial of the binary Hamming scheme (see, e.g., [7, Section 3.2]). This proves the formula for .
As an immediate consequence of the bipartite structure of the hypercube, together with (5.12) and Corollary 2.2, one obtains the following identity for Chebyshev polynomials.
Corollary 5.7.
For every and every , one has
Remark 5.8.
The identity of the previous corollary can also be derived directly from the spectrum of the hypercube. Indeed, the adjacency eigenvalues of are , , with multiplicity . Since
the spectrum is symmetric with respect to the origin. Moreover, is an odd polynomial. Consequently, the terms corresponding to and cancel pairwise, which yields the identity.
Using the formula for in (1.11) and grouping the spectral side by Hamming weights, we obtain the following twisted Krawtchouk–Chebyshev identity.
Corollary 5.9.
Let and let . Then, for every and every real number , one has
| (5.13) |
Proof.
We want to apply (1.11) to the hypercube . Choose such that . For any , the corresponding eigenvalue of is . Therefore, after multiplying by , the spectral side of (1.11) becomes
Hence (1.11) yields
for all satisfying (1.2), where . Since , we have . Substituting (5.11) into the above identity and simplifying, we obtain
Dividing by and introducing , we obtain
and therefore (5.13) holds true for all for which satisfy (1.2). This range contains infinitely many , and hence extension to all real follows from the fact that both sides of the identity (5.13) are polynomials in . ∎
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