Conserved quantities for the surface quasi-geostrophic equation

As in the previous post, all computations here are at the formal level only.

In the previous blog post, the Euler equations for inviscid incompressible fluid flow were interpreted in a Lagrangian fashion, and then Noether’s theorem invoked to derive the known conservation laws for these equations. In a bit more detail: starting with Lagrangian space and Eulerian space , we let be the space of volume-preserving, orientation-preserving maps from Lagrangian space to Eulerian space. Given a curve , we can define the Lagrangian velocity field as the time derivative of , and the Eulerian velocity field . The volume-preserving nature of ensures that is a divergence-free vector field:

If we formally define the functional

then one can show that the critical points of this functional (with appropriate boundary conditions) obey the Euler equations

for some pressure field . As discussed in the previous post, the time translation symmetry of this functional yields conservation of the Hamiltonian

the rigid motion symmetries of Eulerian space give conservation of the total momentum

and total angular momentum

and the diffeomorphism symmetries of Lagrangian space give conservation of circulation

for any closed loop in , or equivalently pointwise conservation of the Lagrangian vorticity , where is the -form associated with the vector field using the Euclidean metric on , with denoting pullback by .

It turns out that one can generalise the above calculations. Given any self-adjoint operator on divergence-free vector fields , we can define the functional

as we shall see below the fold, critical points of this functional (with appropriate boundary conditions) obey the generalised Euler equations

for some pressure field , where in coordinates is with the usual summation conventions. (When , , and this term can be absorbed into the pressure , and we recover the usual Euler equations.) Time translation symmetry then gives conservation of the Hamiltonian

If the operator commutes with rigid motions on , then we have conservation of total momentum

and total angular momentum

and the diffeomorphism symmetries of Lagrangian space give conservation of circulation

or pointwise conservation of the Lagrangian vorticity . These applications of Noether’s theorem proceed exactly as the previous post; we leave the details to the interested reader.

One particular special case of interest arises in two dimensions , when is the inverse derivative . The vorticity is a -form, which in the two-dimensional setting may be identified with a scalar. In coordinates, if we write , then

Since is also divergence-free, we may therefore write

where the stream function is given by the formula

If we take the curl of the generalised Euler equation (2), we obtain (after some computation) the surface quasi-geostrophic equation

This equation has strong analogies with the three-dimensional incompressible Euler equations, and can be viewed as a simplified model for that system; see this paper of Constantin, Majda, and Tabak for details.

Now we can specialise the general conservation laws derived previously to this setting. The conserved Hamiltonian is

(a law previously observed for this equation in the abovementioned paper of Constantin, Majda, and Tabak). As commutes with rigid motions, we also have (formally, at least) conservation of momentum

(which up to trivial transformations is also expressible in impulse form as , after integration by parts), and conservation of angular momentum

(which up to trivial transformations is ). Finally, diffeomorphism invariance gives pointwise conservation of Lagrangian vorticity , thus is transported by the flow (which is also evident from (3). In particular, all integrals of the form for a fixed function are conserved by the flow.

Noether’s theorem, and the conservation laws for the Euler equations

Throughout this post, we will work only at the formal level of analysis, ignoring issues of convergence of integrals, justifying differentiation under the integral sign, and so forth. (Rigorous justification of the conservation laws and other identities arising from the formal manipulations below can usually be established in an a posteriori fashion once the identities are in hand, without the need to rigorously justify the manipulations used to come up with these identities).

It is a remarkable fact in the theory of differential equations that many of the ordinary and partial differential equations that are of interest (particularly in geometric PDE, or PDE arising from mathematical physics) admit a variational formulation; thus, a collection of one or more fields on a domain taking values in a space will solve the differential equation of interest if and only if is a critical point to the functional

involving the fields and their first derivatives , where the Lagrangian is a function on the vector bundle over consisting of triples with , , and a linear transformation; we also usually keep the boundary data of fixed in case has a non-trivial boundary, although we will ignore these issues here. (We also ignore the possibility of having additional constraints imposed on and , which require the machinery of Lagrange multipliers to deal with, but which will only serve as a distraction for the current discussion.) It is common to use local coordinates to parameterise as and as , in which case can be viewed locally as a function on .

Example 1 (Geodesic flow) Take and to be a Riemannian manifold, which we will write locally in coordinates as with metric for . A geodesic is then a critical point (keeping fixed) of the energy functional

or in coordinates (ignoring coordinate patch issues, and using the usual summation conventions)

As discussed in this previous post, both the Euler equations for rigid body motion, and the Euler equations for incompressible inviscid flow, can be interpreted as geodesic flow (though in the latter case, one has to work really formally, as the manifold is now infinite dimensional).

More generally, if is itself a Riemannian manifold, which we write locally in coordinates as with metric for , then a harmonic map is a critical point of the energy functional

or in coordinates (again ignoring coordinate patch issues)

If we replace the Riemannian manifold by a Lorentzian manifold, such as Minkowski space , then the notion of a harmonic map is replaced by that of a wave map, which generalises the scalar wave equation (which corresponds to the case ).

Example 2 (-particle interactions) Take and ; then a function can be interpreted as a collection of trajectories in space, which we give a physical interpretation as the trajectories of particles. If we assign each particle a positive mass , and also introduce a potential energy function , then it turns out that Newton’s laws of motion in this context (with the force on the particle being given by the conservative force ) are equivalent to the trajectories being a critical point of the action functional

Formally, if is a critical point of a functional , this means that

whenever is a (smooth) deformation with (and with respecting whatever boundary conditions are appropriate). Interchanging the derivative and integral, we (formally, at least) arrive at

Write for the infinitesimal deformation of . By the chain rule, can be expressed in terms of . In coordinates, we have

where we parameterise by , and we use subscripts on to denote partial derivatives in the various coefficients. (One can of course work in a coordinate-free manner here if one really wants to, but the notation becomes a little cumbersome due to the need to carefully split up the tangent space of , and we will not do so here.) Thus we can view (2) as an integral identity that asserts the vanishing of a certain integral, whose integrand involves , where vanishes at the boundary but is otherwise unconstrained.

A general rule of thumb in PDE and calculus of variations is that whenever one has an integral identity of the form for some class of functions that vanishes on the boundary, then there must be an associated differential identity that justifies this integral identity through Stokes’ theorem. This rule of thumb helps explain why integration by parts is used so frequently in PDE to justify integral identities. The rule of thumb can fail when one is dealing with “global” or “cohomologically non-trivial” integral identities of a topological nature, such as the Gauss-Bonnet or Kazhdan-Warner identities, but is quite reliable for “local” or “cohomologically trivial” identities, such as those arising from calculus of variations.

In any case, if we apply this rule to (2), we expect that the integrand should be expressible as a spatial divergence. This is indeed the case:

Proposition 1 (Formal) Let be a critical point of the functional defined in (1). Then for any deformation with , we have

where is the vector field that is expressible in coordinates as

Proof: Comparing (4) with (3), we see that the claim is equivalent to the Euler-Lagrange equation

The same computation, together with an integration by parts, shows that (2) may be rewritten as

Since is unconstrained on the interior of , the claim (6) follows (at a formal level, at least).

Many variational problems also enjoy one-parameter continuous symmetries: given any field (not necessarily a critical point), one can place that field in a one-parameter family with , such that

for all ; in particular,

which can be written as (2) as before. Applying the previous rule of thumb, we thus expect another divergence identity

whenever arises from a continuous one-parameter symmetry. This expectation is indeed the case in many examples. For instance, if the spatial domain is the Euclidean space , and the Lagrangian (when expressed in coordinates) has no direct dependence on the spatial variable , thus

then we obtain translation symmetries

for , where is the standard basis for . For a fixed , the left-hand side of (7) then becomes

where . Another common type of symmetry is a pointwise symmetry, in which

for all , in which case (7) clearly holds with .

If we subtract (4) from (7), we obtain the celebrated theorem of Noether linking symmetries with conservation laws:

Theorem 2 (Noether’s theorem) Suppose that is a critical point of the functional (1), and let be a one-parameter continuous symmetry with . Let be the vector field in (5), and let be the vector field in (7). Then we have the pointwise conservation law

In particular, for one-dimensional variational problems, in which , we have the conservation law for all (assuming of course that is connected and contains ).

Noether’s theorem gives a systematic way to locate conservation laws for solutions to variational problems. For instance, if and the Lagrangian has no explicit time dependence, thus

then by using the time translation symmetry , we have

as discussed previously, whereas we have , and hence by (5)

and so Noether’s theorem gives conservation of the Hamiltonian

For instance, for geodesic flow, the Hamiltonian works out to be

so we see that the speed of the geodesic is conserved over time.

For pointwise symmetries (9), vanishes, and so Noether’s theorem simplifies to ; in the one-dimensional case , we thus see from (5) that the quantity

is conserved in time. For instance, for the -particle system in Example 2, if we have the translation invariance

for all , then we have the pointwise translation symmetry

for all , and some , in which case , and the conserved quantity (11) becomes

as was arbitrary, this establishes conservation of the total momentum

Similarly, if we have the rotation invariance

for any and , then we have the pointwise rotation symmetry

for any skew-symmetric real matrix , in which case , and the conserved quantity (11) becomes

since is an arbitrary skew-symmetric matrix, this establishes conservation of the total angular momentum

Below the fold, I will describe how Noether’s theorem can be used to locate all of the conserved quantities for the Euler equations of inviscid fluid flow, discussed in this previous post, by interpreting that flow as geodesic flow in an infinite dimensional manifold.

Conserved quantities for the Euler equations

The Euler equations for incompressible inviscid fluids may be written as

where is the velocity field, and is the pressure field. To avoid technicalities we will assume that both fields are smooth, and that is bounded. We will take the dimension to be at least two, with the three-dimensional case being of course especially interesting.

The Euler equations are the inviscid limit of the Navier-Stokes equations; as discussed in my previous post, one potential route to establishing finite time blowup for the latter equations when is to be able to construct “computers” solving the Euler equations, which generate smaller replicas of themselves in a noise-tolerant manner (as the viscosity term in the Navier-Stokes equation is to be viewed as perturbative noise).

Perhaps the most prominent obstacles to this route are the conservation laws for the Euler equations, which limit the types of final states that a putative computer could reach from a given initial state. Most famously, we have the conservation of energy

 

(assuming sufficient decay of the velocity field at infinity); thus for instance it would not be possible for a computer to generate a replica of itself which had greater total energy than the initial computer. This by itself is not a fatal obstruction (in this paper of mine, I constructed such a “computer” for an averaged Euler equation that still obeyed energy conservation). However, there are other conservation laws also, for instance in three dimensions one also has conservation of helicity

 

and (formally, at least) one has conservation of momentum

and angular momentum

(although, as we shall discuss below, due to the slow decay of at infinity, these integrals have to either be interpreted in a principal value sense, or else replaced with their vorticity-based formulations, namely impulse and moment of impulse). Total vorticity

is also conserved, although it turns out in three dimensions that this quantity vanishes when one assumes sufficient decay at infinity. Then there are the pointwise conservation laws: the vorticity and the volume form are both transported by the fluid flow, while the velocity field (when viewed as a covector) is transported up to a gradient; among other things, this gives the transport of vortex lines as well as Kelvin’s circulation theorem, and can also be used to deduce the helicity conservation law mentioned above. In my opinion, none of these laws actually prohibits a self-replicating computer from existing within the laws of ideal fluid flow, but they do significantly complicate the task of actually designing such a computer, or of the basic “gates” that such a computer would consist of.

Below the fold I would like to record and derive all the conservation laws mentioned above, which to my knowledge essentially form the complete set of known conserved quantities for the Euler equations. The material here (although not the notation) is drawn from this text of Majda and Bertozzi.

Finite time blowup for an averaged three-dimensional Navier-Stokes equation

I’ve just uploaded to the arXiv the paper “Finite time blowup for an averaged three-dimensional Navier-Stokes equation“, submitted to J. Amer. Math. Soc.. The main purpose of this paper is to formalise the “supercriticality barrier” for the global regularity problem for the Navier-Stokes equation, which roughly speaking asserts that it is not possible to establish global regularity by any “abstract” approach which only uses upper bound function space estimates on the nonlinear part of the equation, combined with the energy identity. This is done by constructing a modification of the Navier-Stokes equations with a nonlinearity that obeys essentially all of the function space estimates that the true Navier-Stokes nonlinearity does, and which also obeys the energy identity, but for which one can construct solutions that blow up in finite time. Results of this type had been previously established by Montgomery-Smith, Gallagher-Paicu, and Li-Sinai for variants of the Navier-Stokes equation without the energy identity, and by Katz-Pavlovic and by Cheskidov for dyadic analogues of the Navier-Stokes equations in five and higher dimensions that obeyed the energy identity (see also the work of Plechac and Sverak and of Hou and Lei that also suggest blowup for other Navier-Stokes type models obeying the energy identity in five and higher dimensions), but to my knowledge this is the first blowup result for a Navier-Stokes type equation in three dimensions that also obeys the energy identity. Intriguingly, the method of proof in fact hints at a possible route to establishing blowup for the true Navier-Stokes equations, which I am now increasingly inclined to believe is the case (albeit for a very small set of initial data).

To state the results more precisely, recall that the Navier-Stokes equations can be written in the form

for a divergence-free velocity field and a pressure field , where is the viscosity, which we will normalise to be one. We will work in the non-periodic setting, so the spatial domain is , and for sake of exposition I will not discuss matters of regularity or decay of the solution (but we will always be working with strong notions of solution here rather than weak ones). Applying the Leray projection to divergence-free vector fields to this equation, we can eliminate the pressure, and obtain an evolution equation

purely for the velocity field, where is a certain bilinear operator on divergence-free vector fields (specifically, . The global regularity problem for Navier-Stokes is then equivalent to the global regularity problem for the evolution equation (1).

An important feature of the bilinear operator appearing in (1) is the cancellation law

(using the inner product on divergence-free vector fields), which leads in particular to the fundamental energy identity

This identity (and its consequences) provide essentially the only known a priori bound on solutions to the Navier-Stokes equations from large data and arbitrary times. Unfortunately, as discussed in this previous post, the quantities controlled by the energy identity are supercritical with respect to scaling, which is the fundamental obstacle that has defeated all attempts to solve the global regularity problem for Navier-Stokes without any additional assumptions on the data or solution (e.g. perturbative hypotheses, or a priori control on a critical norm such as the norm).

Our main result is then (slightly informally stated) as follows

Theorem 1 There exists an averaged version of the bilinear operator , of the form

for some probability space , some spatial rotation operators for , and some Fourier multipliers of order , for which one still has the cancellation law

and for which the averaged Navier-Stokes equation

admits solutions that blow up in finite time.

(There are some integrability conditions on the Fourier multipliers required in the above theorem in order for the conclusion to be non-trivial, but I am omitting them here for sake of exposition.)

Because spatial rotations and Fourier multipliers of order are bounded on most function spaces, automatically obeys almost all of the upper bound estimates that does. Thus, this theorem blocks any attempt to prove global regularity for the true Navier-Stokes equations which relies purely on the energy identity and on upper bound estimates for the nonlinearity; one must use some additional structure of the nonlinear operator which is not shared by an averaged version . Such additional structure certainly exists – for instance, the Navier-Stokes equation has a vorticity formulation involving only differential operators rather than pseudodifferential ones, whereas a general equation of the form (2) does not. However, “abstract” approaches to global regularity generally do not exploit such structure, and thus cannot be used to affirmatively answer the Navier-Stokes problem.

It turns out that the particular averaged bilinear operator that we will use will be a finite linear combination of local cascade operators, which take the form

where is a small parameter, are Schwartz vector fields whose Fourier transform is supported on an annulus, and is an -rescaled version of (basically a “wavelet” of wavelength about centred at the origin). Such operators were essentially introduced by Katz and Pavlovic as dyadic models for ; they have the essentially the same scaling property as (except that one can only scale along powers of , rather than over all positive reals), and in fact they can be expressed as an average of in the sense of the above theorem, as can be shown after a somewhat tedious amount of Fourier-analytic symbol manipulations.

If we consider nonlinearities which are a finite linear combination of local cascade operators, then the equation (2) more or less collapses to a system of ODE in certain “wavelet coefficients” of . The precise ODE that shows up depends on what precise combination of local cascade operators one is using. Katz and Pavlovic essentially considered a single cascade operator together with its “adjoint” (needed to preserve the energy identity), and arrived (more or less) at the system of ODE

where are scalar fields for each integer . (Actually, Katz-Pavlovic worked with a technical variant of this particular equation, but the differences are not so important for this current discussion.) Note that the quadratic terms on the RHS carry a higher exponent of than the dissipation term; this reflects the supercritical nature of this evolution (the energy is monotone decreasing in this flow, so the natural size of given the control on the energy is ). There is a slight technical issue with the dissipation if one wishes to embed (3) into an equation of the form (2), but it is minor and I will not discuss it further here.

In principle, if the mode has size comparable to at some time , then energy should flow from to at a rate comparable to , so that by time or so, most of the energy of should have drained into the mode (with hardly any energy dissipated). Since the series is summable, this suggests finite time blowup for this ODE as the energy races ever more quickly to higher and higher modes. Such a scenario was indeed established by Katz and Pavlovic (and refined by Cheskidov) if the dissipation strength was weakened somewhat (the exponent has to be lowered to be less than ). As mentioned above, this is enough to give a version of Theorem 1 in five and higher dimensions.

On the other hand, it was shown a few years ago by Barbato, Morandin, and Romito that (3) in fact admits global smooth solutions (at least in the dyadic case , and assuming non-negative initial data). Roughly speaking, the problem is that as energy is being transferred from to , energy is also simultaneously being transferred from to , and as such the solution races off to higher modes a bit too prematurely, without absorbing all of the energy from lower modes. This weakens the strength of the blowup to the point where the moderately strong dissipation in (3) is enough to kill the high frequency cascade before a true singularity occurs. Because of this, the original Katz-Pavlovic model cannot quite be used to establish Theorem 1 in three dimensions. (Actually, the original Katz-Pavlovic model had some additional dispersive features which allowed for another proof of global smooth solutions, which is an unpublished result of Nazarov.)

To get around this, I had to “engineer” an ODE system with similar features to (3) (namely, a quadratic nonlinearity, a monotone total energy, and the indicated exponents of for both the dissipation term and the quadratic terms), but for which the cascade of energy from scale to scale was not interrupted by the cascade of energy from scale to scale . To do this, I needed to insert a delay in the cascade process (so that after energy was dumped into scale , it would take some time before the energy would start to transfer to scale ), but the process also needed to be abrupt (once the process of energy transfer started, it needed to conclude very quickly, before the delayed transfer for the next scale kicked in). It turned out that one could build a “quadratic circuit” out of some basic “quadratic gates” (analogous to how an electrical circuit could be built out of basic gates such as amplifiers or resistors) that achieved this task, leading to an ODE system essentially of the form

where is a suitable large parameter and is a suitable small parameter (much smaller than ). To visualise the dynamics of such a system, I found it useful to describe this system graphically by a “circuit diagram” that is analogous (but not identical) to the circuit diagrams arising in electrical engineering:

The coupling constants here range widely from being very large to very small; in practice, this makes the and modes absorb very little energy, but exert a sizeable influence on the remaining modes. If a lot of energy is suddenly dumped into , what happens next is roughly as follows: for a moderate period of time, nothing much happens other than a trickle of energy into , which in turn causes a rapid exponential growth of (from a very low base). After this delay, suddenly crosses a certain threshold, at which point it causes and to exchange energy back and forth with extreme speed. The energy from then rapidly drains into , and the process begins again (with a slight loss in energy due to the dissipation). If one plots the total energy as a function of time, it looks schematically like this:

As in the previous heuristic discussion, the time between cascades from one frequency scale to the next decay exponentially, leading to blowup at some finite time . (One could describe the dynamics here as being similar to the famous “lighting the beacons” scene in the Lord of the Rings movies, except that (a) as each beacon gets ignited, the previous one is extinguished, as per the energy identity; (b) the time between beacon lightings decrease exponentially; and (c) there is no soundtrack.)

There is a real (but remote) possibility that this sort of construction can be adapted to the true Navier-Stokes equations. The basic blowup mechanism in the averaged equation is that of a von Neumann machine, or more precisely a construct (built within the laws of the inviscid evolution ) that, after some time delay, manages to suddenly create a replica of itself at a finer scale (and to largely erase its original instantiation in the process). In principle, such a von Neumann machine could also be built out of the laws of the inviscid form of the Navier-Stokes equations (i.e. the Euler equations). In physical terms, one would have to build the machine purely out of an ideal fluid (i.e. an inviscid incompressible fluid). If one could somehow create enough “logic gates” out of ideal fluid, one could presumably build a sort of “fluid computer”, at which point the task of building a von Neumann machine appears to reduce to a software engineering exercise rather than a PDE problem (providing that the gates are suitably stable with respect to perturbations, but (as with actual computers) this can presumably be done by converting the analog signals of fluid mechanics into a more error-resistant digital form). The key thing missing in this program (in both senses of the word) to establish blowup for Navier-Stokes is to construct the logic gates within the laws of ideal fluids. (Compare with the situation for cellular automata such as Conway’s “Game of Life“, in which Turing complete computers, universal constructors, and replicators have all been built within the laws of that game.)

A physical space proof of the bilinear Strichartz and local smoothing estimates for the Schrodinger equation

The purpose of this post is to link to a short unpublished note of mine that I wrote back in 2010 but forgot to put on my web page at the time. Entitled “A physical space proof of the bilinear Strichartz and local smoothing estimates for the Schrodinger equation“, it gives a proof of two standard estimates for the free (linear) Schrodinger equation in flat Euclidean space, namely the bilinear Strichartz estimate and the local smoothing estimate, using primarily “physical space” methods such as integration by parts, instead of “frequency space” methods based on the Fourier transform, although a small amount of Fourier analysis (basically sectoral projection to make the Schrodinger waves move roughly in a given direction) is still needed.  This is somewhat in the spirit of an older paper of mine with Klainerman and Rodnianski doing something similar for the wave equation, and is also very similar to a paper of Planchon and Vega from 2009.  The hope was that by avoiding the finer properties of the Fourier transform, one could obtain a more robust argument which could also extend to nonlinear, non-free, or non-flat situations.   These notes were cited once or twice by some people that I had privately circulated them to, so I decided to put them online here for reference.

UPDATE, July 24: Fabrice Planchon has kindly supplied another note in which he gives a particularly simple proof of local smoothing in one dimension, and discusses some other variants of the method (related to the paper of Planchon and Vega cited earlier).

The pseudoconformal and conformal transformations

Consider the free Schrödinger equation in spatial dimensions, which I will normalise as

where is the unknown field and is the spatial Laplacian. To avoid irrelevant technical issues I will restrict attention to smooth (classical) solutions to this equation, and will work locally in spacetime avoiding issues of decay at infinity (or at other singularities); I will also avoid issues involving branch cuts of functions such as (if one wishes, one can restrict to be even in order to safely ignore all branch cut issues). The space of solutions to (1) enjoys a number of symmetries. A particularly non-obvious symmetry is the pseudoconformal symmetry: if solves (1), then the pseudoconformal solution defined by

for can be seen after some computation to also solve (1). (If has suitable decay at spatial infinity and one chooses a suitable branch cut for , one can extend continuously to the spatial slice, whereupon it becomes essentially the spatial Fourier transform of , but we will not need this fact for the current discussion.)

An analogous symmetry exists for the free wave equation in spatial dimensions, which I will write as

where is the unknown field. In analogy to pseudoconformal symmetry, we have conformal symmetry: if solves (3), then the function , defined in the interior of the light cone by the formula

also solves (3).

There are also some direct links between the Schrödinger equation in dimensions and the wave equation in dimensions. This can be easily seen on the spacetime Fourier side: solutions to (1) have spacetime Fourier transform (formally) supported on a -dimensional hyperboloid, while solutions to (3) have spacetime Fourier transform formally supported on a -dimensional cone. To link the two, one then observes that the -dimensional hyperboloid can be viewed as a conic section (i.e. hyperplane slice) of the -dimensional cone. In physical space, this link is manifested as follows: if solves (1), then the function defined by

solves (3). More generally, for any non-zero scaling parameter , the function defined by

solves (3).

As an “extra challenge” posed in an exercise in one of my books (Exercise 2.28, to be precise), I asked the reader to use the embeddings (or more generally ) to explicitly connect together the pseudoconformal transformation and the conformal transformation . It turns out that this connection is a little bit unusual, with the “obvious” guess (namely, that the embeddings intertwine and ) being incorrect, and as such this particular task was perhaps too difficult even for a challenge question. I’ve been asked a couple times to provide the connection more explicitly, so I will do so below the fold.

Some notes on Bakry-Emery theory

[These are notes intended mostly for myself, as these topics are useful in random matrix theory, but may be of interest to some readers also. -T.]

One of the most fundamental partial differential equations in mathematics is the heat equation

where is a scalar function of both time and space, and is the Laplacian . For the purposes of this post, we will ignore all technical issues of regularity and decay, and always assume that the solutions to equations such as (1) have all the regularity and decay in order to justify all formal operations such as the chain rule, integration by parts, or differentiation under the integral sign. The factor of in the definition of the heat propagator is of course an arbitrary normalisation, chosen for some minor technical reasons; one can certainly continue the discussion below with other choices of normalisations if desired.

In probability theory, this equation takes on particular significance when is restricted to be non-negative, and furthermore to be a probability measure at each time, in the sense that

for all . (Actually, it suffices to verify this constraint at time , as the heat equation (1) will then preserve this constraint.) Indeed, in this case, one can interpret as the probability distribution of a Brownian motion

where is a stochastic process with initial probability distribution ; see for instance this previous blog post for more discussion.

A model example of a solution to the heat equation to keep in mind is that of the fundamental solution

defined for any , which represents the distribution of Brownian motion of a particle starting at the origin at time . At time , represents an -valued random variable, each coefficient of which is an independent random variable of mean zero and variance . (As , converges in the sense of distributions to a Dirac mass at the origin.)

The heat equation can also be viewed as the gradient flow for the Dirichlet form

since one has the integration by parts identity

for all smooth, rapidly decreasing , which formally implies that is (half of) the negative gradient of the Dirichlet energy with respect to the inner product. Among other things, this implies that the Dirichlet energy decreases in time:

For instance, for the fundamental solution (3), one can verify for any time that

(assuming I have not made a mistake in the calculation). In a similar spirit we have

Since is non-negative, the formula (6) implies that is integrable in time, and in particular we see that converges to zero as , in some averaged sense at least; similarly, (8) suggests that also converges to zero. This suggests that converges to a constant function; but as is also supposed to decay to zero at spatial infinity, we thus expect solutions to the heat equation in to decay to zero in some sense as . However, the decay is only expected to be polynomial in nature rather than exponential; for instance, the solution (3) decays in the norm like .

Since , we also observe the basic cancellation property

for any function .

There are other quantities relating to that also decrease in time under heat flow, particularly in the important case when is a probability measure. In this case, it is natural to introduce the entropy

Thus, for instance, if is the uniform distribution on some measurable subset of of finite measure , the entropy would be . Intuitively, as the entropy decreases, the probability distribution gets wider and flatter. For instance, in the case of the fundamental solution (3), one has for any , reflecting the fact that is approximately uniformly distributed on a ball of radius (and thus of measure ).

A short formal computation shows (if one assumes for simplicity that is strictly positive, which is not an unreasonable hypothesis, particularly in view of the strong maximum principle) using (9), (5) that

where is the square root of . For instance, if is the fundamental solution (3), one can check that (note that this is a significantly cleaner formula than (7)!).

In particular, the entropy is decreasing, which corresponds well to one’s intuition that the heat equation (or Brownian motion) should serve to spread out a probability distribution over time.

Actually, one can say more: the rate of decrease of the entropy is itself decreasing, or in other words the entropy is convex. I do not have a satisfactorily intuitive reason for this phenomenon, but it can be proved by straightforward application of basic several variable calculus tools (such as the chain rule, product rule, quotient rule, and integration by parts), and completing the square. Namely, by using the chain rule we have

valid for for any smooth function , we see from (1) that

and thus (again assuming that , and hence , is strictly positive to avoid technicalities)

We thus have

It is now convenient to compute using the Einstein summation convention to hide the summation over indices . We have

and

By integration by parts and interchanging partial derivatives, we may write the first integral as

and from the quotient and product rules, we may write the second integral as

Gathering terms, completing the square, and making the summations explicit again, we see that

and so in particular is always decreasing.

The above identity can also be written as

Exercise 1 Give an alternate proof of the above identity by writing , and deriving the equation for .

It was observed in a well known paper of Bakry and Emery that the above monotonicity properties hold for a much larger class of heat flow-type equations, and lead to a number of important relations between energy and entropy, such as the log-Sobolev inequality of Gross and of Federbush, and the hypercontractivity inequality of Nelson; we will discuss one such family of generalisations (or more precisely, variants) below the fold.

Lars Hormander

Lars Hörmander, who made fundamental contributions to all areas of partial differential equations, but particularly in developing the analysis of variable-coefficient linear PDE, died last Sunday, aged 81.

I unfortunately never met Hörmander personally, but of course I encountered his work all the time while working in PDE. One of his major contributions to the subject was to systematically develop the calculus of Fourier integral operators (FIOs), which are a substantial generalisation of pseudodifferential operators and which can be used to (approximately) solve linear partial differential equations, or to transform such equations into a more convenient form. Roughly speaking, Fourier integral operators are to linear PDE as canonical transformations are to Hamiltonian mechanics (and one can in fact view FIOs as a quantisation of a canonical transformation). They are a large class of transformations, for instance the Fourier transform, pseudodifferential operators, and smooth changes of the spatial variable are all examples of FIOs, and (as long as certain singular situations are avoided) the composition of two FIOs is again an FIO.

The full theory of FIOs is quite extensive, occupying the entire final volume of Hormander’s famous four-volume series “The Analysis of Linear Partial Differential Operators”. I am certainly not going to try to attempt to summarise it here, but I thought I would try to motivate how these operators arise when trying to transform functions. For simplicity we will work with functions on a Euclidean domain (although FIOs can certainly be defined on more general smooth manifolds, and there is an extension of the theory that also works on manifolds with boundary). As this will be a heuristic discussion, we will ignore all the (technical, but important) issues of smoothness or convergence with regards to the functions, integrals and limits that appear below, and be rather vague with terms such as “decaying” or “concentrated”.

A function can be viewed from many different perspectives (reflecting the variety of bases, or approximate bases, that the Hilbert space offers). Most directly, we have the physical space perspective, viewing as a function of the physical variable . In many cases, this function will be concentrated in some subregion of physical space. For instance, a gaussian wave packet

where , and are parameters, would be physically concentrated in the ball . Then we have the frequency space (or momentum space) perspective, viewing now as a function of the frequency variable . For this discussion, it will be convenient to normalise the Fourier transform using a small constant (which has the physical interpretation of Planck’s constant if one is doing quantum mechanics), thus

For instance, for the gaussian wave packet (1), one has

and so we see that is concentrated in frequency space in the ball .

However, there is a third (but less rigorous) way to view a function in , which is the phase space perspective in which one tries to view as distributed simultaneously in physical space and in frequency space, thus being something like a measure on the phase space . Thus, for instance, the function (1) should heuristically be concentrated on the region in phase space. Unfortunately, due to the uncertainty principle, there is no completely satisfactory way to canonically and rigorously define what the “phase space portrait” of a function should be. (For instance, the Wigner transform of can be viewed as an attempt to describe the distribution of the energy of in phase space, except that this transform can take negative or even complex values; see Folland’s book for further discussion.) Still, it is a very useful heuristic to think of functions has having a phase space portrait, which is something like a non-negative measure on phase space that captures the distribution of functions in both space and frequency, albeit with some “quantum fuzziness” that shows up whenever one tries to inspect this measure at scales of physical space and frequency space that together violate the uncertainty principle. (The score of a piece of music is a good everyday example of a phase space portrait of a function, in this case a sound wave; here, the physical space is the time axis (the horizontal dimension of the score) and the frequency space is the vertical dimension. Here, the time and frequency scales involved are well above the uncertainty principle limit (a typical note lasts many hundreds of cycles, whereas the uncertainty principle kicks in at cycles) and so there is no obstruction here to musical notation being unambiguous.) Furthermore, if one takes certain asymptotic limits, one can recover a precise notion of a phase space portrait; for instance if one takes the semiclassical limit then, under certain circumstances, the phase space portrait converges to a well-defined classical probability measure on phase space; closely related to this is the high frequency limit of a fixed function, which among other things defines the wave front set of that function, which can be viewed as another asymptotic realisation of the phase space portrait concept.

If functions in can be viewed as a sort of distribution in phase space, then linear operators should be viewed as various transformations on such distributions on phase space. For instance, a pseudodifferential operator should correspond (as a zeroth approximation) to multiplying a phase space distribution by the symbol of that operator, as discussed in this previous blog post. Note that such operators only change the amplitude of the phase space distribution, but not the support of that distribution.

Now we turn to operators that alter the support of a phase space distribution, rather than the amplitude; we will focus on unitary operators to emphasise the amplitude preservation aspect. These will eventually be key examples of Fourier integral operators. A physical translation should correspond to pushing forward the distribution by the transformation , as can be seen by comparing the physical and frequency space supports of with that of . Similarly, a frequency modulation should correspond to the transformation ; a linear change of variables , where is an invertible linear transformation, should correspond to ; and finally, the Fourier transform should correspond to the transformation .

Based on these examples, one may hope that given any diffeomorphism of phase space, one could associate some sort of unitary (or approximately unitary) operator , which (heuristically, at least) pushes the phase space portrait of a function forward by . However, there is an obstruction to doing so, which can be explained as follows. If pushes phase space portraits by , and pseudodifferential operators multiply phase space portraits by , then this suggests the intertwining relationship

and thus is approximately conjugate to :

The formalisation of this fact in the theory of Fourier integral operators is known as Egorov’s theorem, due to Yu Egorov (and not to be confused with the more widely known theorem of Dmitri Egorov in measure theory).

Applying commutators, we conclude the approximate conjugacy relationship

Now, the pseudodifferential calculus (as discussed in this previous post) tells us (heuristically, at least) that

and

where is the Poisson bracket. Comparing this with (2), we are then led to the compatibility condition

thus needs to preserve (approximately, at least) the Poisson bracket, or equivalently needs to be a symplectomorphism (again, approximately at least).

Now suppose that is a symplectomorphism. This is morally equivalent to the graph being a Lagrangian submanifold of (where we give the second copy of phase space the negative of the usual symplectic form , thus yielding as the full symplectic form on ; this is another instantiation of the closed graph theorem, as mentioned in this previous post. This graph is known as the canonical relation for the (putative) FIO that is associated to . To understand what it means for this graph to be Lagrangian, we coordinatise as suppose temporarily that this graph was (locally, at least) a smooth graph in the and variables, thus

for some smooth functions . A brief computation shows that the Lagrangian property of is then equivalent to the compatibility conditions

for , where denote the components of . Some Fourier analysis (or Hodge theory) lets us solve these equations as

for some smooth potential function . Thus, we have parameterised our graph as

so that maps to .

A reasonable candidate for an operator associated to and in this fashion is the oscillatory integral operator

for some smooth amplitude function (note that the Fourier transform is the special case when and , which helps explain the genesis of the term “Fourier integral operator”). Indeed, if one computes an inner product for gaussian wave packets of the form (1) and localised in phase space near respectively, then a Taylor expansion of around , followed by a stationary phase computation, shows (again heuristically, and assuming is suitably non-degenerate) that has (3) as its canonical relation. (Furthermore, a refinement of this stationary phase calculation suggests that if is normalised to be the half-density , then should be approximately unitary.) As such, we view (4) as an example of a Fourier integral operator (assuming various smoothness and non-degeneracy hypotheses on the phase and amplitude which we do not detail here).

Of course, it may be the case that is not a graph in the coordinates (for instance, the key examples of translation, modulation, and dilation are not of this form), but then it is often a graph in some other pair of coordinates, such as . In that case one can compose the oscillatory integral construction given above with a Fourier transform, giving another class of FIOs of the form

This class of FIOs covers many important cases; for instance, the translation, modulation, and dilation operators considered earlier can be written in this form after some Fourier analysis. Another typical example is the half-wave propagator for some time , which can be written in the form

This corresponds to the phase space transformation , which can be viewed as the classical propagator associated to the “quantum” propagator . More generally, propagators for linear Hamiltonian partial differential equations can often be expressed (at least approximately) by Fourier integral operators corresponding to the propagator of the associated classical Hamiltonian flow associated to the symbol of the Hamiltonian operator ; this leads to an important mathematical formalisation of the correspondence principle between quantum mechanics and classical mechanics, that is one of the foundations of microlocal analysis and which was extensively developed in Hörmander’s work. (More recently, numerically stable versions of this theory have been developed to allow for rapid and accurate numerical solutions to various linear PDE, for instance through Emmanuel Candés’ theory of curvelets, so the theory that Hörmander built now has some quite significant practical applications in areas such as geology.)

In some cases, the canonical relation may have some singularities (such as fold singularities) which prevent it from being written as graphs in the previous senses, but the theory for defining FIOs even in these cases, and in developing their calculus, is now well established, in large part due to the foundational work of Hörmander.

A direct proof of the stationarity of the Dyson sine process under Dyson Brownian motion

Let be a large natural number, and let be a matrix drawn from the Gaussian Unitary Ensemble (GUE), by which we mean that is a Hermitian matrix whose upper triangular entries are iid complex gaussians with mean zero and variance one, and whose diagonal entries are iid real gaussians with mean zero and variance one (and independent of the upper triangular entries). The eigenvalues are then real and almost surely distinct, and can be viewed as a random point process on the real line. One can then form the -point correlation functions for every , which can be defined by duality by requiring

for any test function . For GUE, which is a continuous matrix ensemble, one can also define for distinct as the unique quantity such that the probability that there is an eigenvalue in each of the intervals is in the limit .

As is well known, the GUE process is a determinantal point process, which means that -point correlation functions can be explicitly computed as

for some kernel ; explicitly, one has

where are the (normalised) Hermite polynomials; see this previous blog post for details.

Using the asymptotics of Hermite polynomials (which then give asymptotics for the kernel ), one can take a limit of a (suitably rescaled) sequence of GUE processes to obtain the Dyson sine process, which is a determinantal point process on the real line with correlation functions

where is the Dyson sine kernel

A bit more precisely, for any fixed bulk energy , the renormalised point processes converge in distribution in the vague topology to as , where is the semi-circular law density.

On the other hand, an important feature of the GUE process is its stationarity (modulo rescaling) under Dyson Brownian motion

which describes the stochastic evolution of eigenvalues of a Hermitian matrix under independent Brownian motion of its entries, and is discussed in this previous blog post. To cut a long story short, this stationarity tells us that the self-similar -point correlation function

obeys the Dyson heat equation

(see Exercise 11 of the previously mentioned blog post). Note that vanishes to second order whenever two of the coincide, so there is no singularity on the right-hand side. Setting and using self-similarity, we can rewrite this equation in time-independent form as

One can then integrate out all but of these variables (after carefully justifying convergence) to obtain a system of equations for the -point correlation functions :

where the integral is interpreted in the principal value case. This system is an example of a BBGKY hierarchy.

If one carefully rescales and takes limits (say at the energy level , for simplicity), the left-hand side turns out to rescale to be a lower order term, and one ends up with a hierarchy for the Dyson sine process:

Informally, these equations show that the Dyson sine process is stationary with respect to the infinite Dyson Brownian motion

where are independent Brownian increments, and the sum is interpreted in a suitable principal value sense.

I recently set myself the exercise of deriving the identity (3) directly from the definition (1) of the Dyson sine process, without reference to GUE. This turns out to not be too difficult when done the right way (namely, by modifying the proof of Gaudin’s lemma), although it did take me an entire day of work before I realised this, and I could not find it in the literature (though I suspect that many people in the field have privately performed this exercise in the past). In any case, I am recording the computation here, largely because I really don’t want to have to do it again, but perhaps it will also be of interest to some readers.

The spectral theorem and its converses for unbounded symmetric operators

Let be a self-adjoint operator on a finite-dimensional Hilbert space . The behaviour of this operator can be completely described by the spectral theorem for finite-dimensional self-adjoint operators (i.e. Hermitian matrices, when viewed in coordinates), which provides a sequence of eigenvalues and an orthonormal basis of eigenfunctions such that for all . In particular, given any function on the spectrum of , one can then define the linear operator by the formula

which then gives a functional calculus, in the sense that the map is a -algebra isometric homomorphism from the algebra of bounded continuous functions from to , to the algebra of bounded linear operators on . Thus, for instance, one can define heat operators for , Schrödinger operators for , resolvents for , and (if is positive) wave operators for . These will be bounded operators (and, in the case of the Schrödinger and wave operators, unitary operators, and in the case of the heat operators with positive, they will be contractions). Among other things, this functional calculus can then be used to solve differential equations such as the heat equation

 

the Schrödinger equation

 

the wave equation

 

or the Helmholtz equation

 

The functional calculus can also be associated to a spectral measure. Indeed, for any vectors , there is a complex measure on with the property that

indeed, one can set to be the discrete measure on defined by the formula

One can also view this complex measure as a coefficient

of a projection-valued measure on , defined by setting

Finally, one can view as unitarily equivalent to a multiplication operator on , where is the real-valued function , and the intertwining map is given by

so that .

It is an important fact in analysis that many of these above assertions extend to operators on an infinite-dimensional Hilbert space , so long as one one is careful about what “self-adjoint operator” means; these facts are collectively referred to as the spectral theorem. For instance, it turns out that most of the above claims have analogues for bounded self-adjoint operators . However, in the theory of partial differential equations, one often needs to apply the spectral theorem to unbounded, densely defined linear operators , which (initially, at least), are only defined on a dense subspace of the Hilbert space . A very typical situation arises when is the square-integrable functions on some domain or manifold (which may have a boundary or be otherwise “incomplete”), and are the smooth compactly supported functions on , and is some linear differential operator. It is then of interest to obtain the spectral theorem for such operators, so that one build operators such as or to solve equations such as (1), (2), (3), (4).

In order to do this, some necessary conditions on the densely defined operator must be imposed. The most obvious is that of symmetry, which asserts that

 

for all . In some applications, one also wants to impose positive definiteness, which asserts that

 

for all . These hypotheses are sufficient in the case when is bounded, and in particular when is finite dimensional. However, as it turns out, for unbounded operators these conditions are not, by themselves, enough to obtain a good spectral theory. For instance, one consequence of the spectral theorem should be that the resolvents are well-defined for any strictly complex , which by duality implies that the image of should be dense in . However, this can fail if one just assumes symmetry, or symmetry and positive definiteness. A well-known example occurs when is the Hilbert space , is the space of test functions, and is the one-dimensional Laplacian . Then is symmetric and positive, but the operator does not have dense image for any complex , since

for all test functions , as can be seen from a routine integration by parts. As such, the resolvent map is not everywhere uniquely defined. There is also a lack of uniqueness for the wave, heat, and Schrödinger equations for this operator (note that there are no spatial boundary conditions specified in these equations).

Another example occurs when , , is the momentum operator . Then the resolvent can be uniquely defined for in the upper half-plane, but not in the lower half-plane, due to the obstruction

for all test functions (note that the function lies in when is in the lower half-plane). For related reasons, the translation operators have a problem with either uniqueness or existence (depending on whether is positive or negative), due to the unspecified boundary behaviour at the origin.

The key property that lets one avoid this bad behaviour is that of essential self-adjointness. Once is essentially self-adjoint, then spectral theorem becomes applicable again, leading to all the expected behaviour (e.g. existence and uniqueness for the various PDE given above).

Unfortunately, the concept of essential self-adjointness is defined rather abstractly, and is difficult to verify directly; unlike the symmetry condition (5) or the positive condition (6), it is not a “local” condition that can be easily verified just by testing on various inputs, but is instead a more “global” condition. In practice, to verify this property, one needs to invoke one of a number of a partial converses to the spectral theorem, which roughly speaking asserts that if at least one of the expected consequences of the spectral theorem is true for some symmetric densely defined operator , then is self-adjoint. Examples of “expected consequences” include:

• Existence of resolvents (or equivalently, dense image for );
• Existence of a contractive heat propagator semigroup (in the positive case);
• Existence of a unitary Schrödinger propagator group ;
• Existence of a unitary wave propagator group (in the positive case);
• Existence of a “reasonable” functional calculus.
• Unitary equivalence with a multiplication operator.

Thus, to actually verify essential self-adjointness of a differential operator, one typically has to first solve a PDE (such as the wave, Schrödinger, heat, or Helmholtz equation) by some non-spectral method (e.g. by a contraction mapping argument, or a perturbation argument based on an operator already known to be essentially self-adjoint). Once one can solve one of the PDEs, then one can apply one of the known converse spectral theorems to obtain essential self-adjointness, and then by the forward spectral theorem one can then solve all the other PDEs as well. But there is no getting out of that first step, which requires some input (typically of an ODE, PDE, or geometric nature) that is external to what abstract spectral theory can provide. For instance, if one wants to establish essential self-adjointness of the Laplace-Beltrami operator on a smooth Riemannian manifold (using as the domain space), it turns out (under reasonable regularity hypotheses) that essential self-adjointness is equivalent to geodesic completeness of the manifold, which is a global ODE condition rather than a local one: one needs geodesics to continue indefinitely in order to be able to (unitarily) solve PDEs such as the wave equation, which in turn leads to essential self-adjointness. (Note that the domains and in the previous examples were not geodesically complete.) For this reason, essential self-adjointness of a differential operator is sometimes referred to as quantum completeness (with the completeness of the associated Hamilton-Jacobi flow then being the analogous classical completeness).

In these notes, I wanted to record (mostly for my own benefit) the forward and converse spectral theorems, and to verify essential self-adjointness of the Laplace-Beltrami operator on geodesically complete manifolds. This is extremely standard analysis (covered, for instance, in the texts of Reed and Simon), but I wanted to write it down myself to make sure that I really understood this foundational material properly.