Space-discretizations of reaction-diffusion SPDEs - Carina Geldhauser Lund University joint work with - FAUbox
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Space-discretizations of reaction-diffusion SPDEs Carina Geldhauser Lund University joint work with A.Bovier (Bonn), Ch. Kuehn (TU Munich) Carina Geldhauser (Lund) Discrete SPDEs FAU-DCN 2021 1 / 23
Why study discrete-in-space (S)PDEs? Reason 1: they appear in nature myelinated nerve fibres formation of shear bands in granular flows enhancement of digital images chemotactic movement of bacteria (reinforced random walks on lattices) Figure: Shear bands in dry population models granular media, Fazekas, Török, Kertesz and Wolf, 2006 Reason 2: it really makes a difference an inherent discrete spatial structure can influence the dynamical behaviour of the physical/chemical/biological system the continuous equation may admit special solutions which the discrete equation does not have Carina Geldhauser (Lund) Discrete SPDEs FAU-DCN 2021 2 / 23
...but also noise may cause new phenomena: metastability Examples of metastable systems undercooled destilled water conformations of proteins stock prices in ”overheated” markets Figure: Energies levels of conformations of cyclohexane Figure: Adams and Vanden-Eijnden, PNAS 2010: counterrotation of HIV-1 gp120 Carina Geldhauser (Lund) Discrete SPDEs FAU-DCN 2021 3 / 23
Outline 1 Framework 1: Particle systems Scaling Limits From discrete to continuous: the SPDE limit 2 Framework 2: Lattice Differential Equations Traveling waves in the PDE model Lattice models Influence of stochastic noise Carina Geldhauser (Lund) Discrete SPDEs FAU-DCN 2021 4 / 23
Framework 1: Particle systems Outline 1 Framework 1: Particle systems Scaling Limits From discrete to continuous: the SPDE limit 2 Framework 2: Lattice Differential Equations Traveling waves in the PDE model Lattice models Influence of stochastic noise Carina Geldhauser (Lund) Discrete SPDEs FAU-DCN 2021 4 / 23
Framework 1: Particle systems What is an interacting particle system? model complex phenomena with large number of components (spins, bacteria...) each particle Xi moves according to a rule (e.g. differential equation) add stochastic term to the movement rule (e.g. ODE) to model microscopic influences or unresolved degrees of freedom A particle Xi is a function of time (and ω), labelled by i = 1 . . . N Xi : [0, T ] × Ω → R (t, ω) 7→ Xi (t, ω) | {z } position of Xi Figure: Lattice of interacting particles, by Nils Berglund Video (Nils Berglund): 128 harmonically coupled Xi , subj. t. white noise Carina Geldhauser (Lund) Discrete SPDEs FAU-DCN 2021 5 / 23
Framework 1: Particle systems Noise-induced metastability rare, abrupt transition from one (meta)stable state to another Questions: expected transition time? most likely transition path? Figure: energy level of conformations of cyclohexane Figure: transition path: Adams & Vanden-Eijnden, adapted by C.G. Carina Geldhauser (Lund) Discrete SPDEs FAU-DCN 2021 6 / 23
Framework 1: Particle systems Local behaviour: symmetric bistable diffusion √ dX (t) = 0 |{z} − V 0 (X (t))dt + 2σdB(t) no interaction movement of one particle X under local drift term −V 0 (u) = u − u 3 local dynamics tends to push the particle towards one of the two stable positions ±1 noise adds small perturbation 4 3.5 3 2.5 2 1.5 1 0.5 0 −2 −1.5 −1 −0.5 0 0.5 1 1.5 2 1 4 1 2 V (u) = 4 u − 2 u Simulation by F. Barret Carina Geldhauser (Lund) Discrete SPDEs FAU-DCN 2021 7 / 23
Framework 1: Particle systems Nearest-neighbour model Setting: N particles Xi (t) on a lattice Λ = Z/NZ move according to γh N i √ dXi (t) = Xi+1 (t) − 2XiN (t) + Xi−1 N (t) dt−V 0 (Xi (t))dt + 2σd B e i (t) 2 (SDE) nearest-neighbour interaction, strength γ > 0 sufficiently strong to allow synchronization nonlinear local drift term: −V 0 (x ) = x − x 3 , B e i indep. BM Scaling limit choose noise strength appropriately strong, perform diffusive rescaling Result: solutions to the system (SDE) converge as N → ∞ to solutions to the Stochastic Allen Cahn equation Funaki, Gyöngy, Millet, Berglund, Gentz, Fernandez, Barret, Bovier, Meleard Carina Geldhauser (Lund) Discrete SPDEs FAU-DCN 2021 8 / 23
Framework 1: Particle systems Scaling Limits From particles to (S)PDEs Situation: Often particles = molecules, atoms .... # particles/mol ≈ 1023 Difficult to study a huge system of differential equations! Goal: Want to find global or effective behaviour of the particle system Strategy: Zoom out and let particle distance h → 0 (“Rescaling”) Several scaling limits are used in statistical physics. 2 categories: macroscopic limits “effective” behaviour of the system, noise disappears as h → 0 example: hydrodynamic limit (à la Kipnis-Landim) often: “speed up time” by a factor N 2 = 1/h2 mesoscopic limits (SPDE limits) fluctuation is still present in the limit equation example: SPDE limit often “speed up time” by a factor N = 1/h Carina Geldhauser (Lund) Discrete SPDEs FAU-DCN 2021 9 / 23
Framework 1: Particle systems Scaling Limits ∗ Details on diffusive rescaling 1 Rescale Λ = Z/NZ by h = N uniform grid Th = {0, h, . . . , Nh} Rescale the coupling constant γ by h−1 and V by h. Accelerate time by a factor h1 , set Xe N (t) = X (t/h) get a different sequence of indep. BM, call them Bi (t) get extra h−1 for the interaction, the scaling h on V cancels out Get rescaled system of SDEs for i ∈ Th s R γ X 2σ dui (t) = 3 2 JR (j) (ui+j (t) − ui (t)) dt − V 0 (ui (t))dt + dBi (t) R h j=−R h e N (t) ≡ ui (t) function of nodal values at the node i, Notation: X i h u (t) = (u1 (t), . . . uN (t)) piecewise linear function on [0, 1]. Carina Geldhauser (Lund) Discrete SPDEs FAU-DCN 2021 10 / 23
Framework 1: Particle systems From discrete to continuous: the SPDE limit Types of interactions N (t) − 2X N (t) + X N (t) Nearest-neighbor-interaction: Xi+1 i i−1 0 i −R i −j i −2 i −1 i i +1 i +2 i +j i +R N Long-range interaction: all particles Xj withdistance up to R to Xi interact with strength JR (j) γ R N N j=−R JR (j) Xi+j (t) − Xi (t) P J(-R) J(R) 0 i −R i −j i −2 i −1 i i +1 i +2 i +j i +R N Our question: what happens if we take the simultaneous limit N → ∞ and R → ∞ in the long-range interaction system? Carina Geldhauser (Lund) Discrete SPDEs FAU-DCN 2021 11 / 23
Framework 1: Particle systems From discrete to continuous: the SPDE limit Possible limit SPDEs R 1 X Denote formally Au := lim JR (j) (ui+j − ui ) . h→0 R 3 h2 j=−R What can be said about the limit equation √ ∂t u = γAu − V 0 (u) + 2σξ in T × R+ ? (SPDE) For finite R and reasonable choices of JR (j), the limit operator A is (a multiple of) the Laplacian ⇒ solutions to (SPDE) are 2α-Hölder in 1 space and α-Hölder in time for every α ∈ 0, 4 . For R = h1 , the limit operator is given by A = J ∗ u mean-field interaction, solutions only as regular as the noise solutions to (SPDE) are distributions, u 3 is not defined Our result: (SPDE) is well-defined up to R ∼ N ζ with ζ < 1/2. Carina Geldhauser (Lund) Discrete SPDEs FAU-DCN 2021 12 / 23
Framework 1: Particle systems From discrete to continuous: the SPDE limit ∗ Behaviour of the interaction term or: why ζ < 21 ? Let λhk be the eigenvalues of γAhR ui = R 3γh2 RR j=−R JR (j) (ui+j (t) − ui (t)) P with periodic boundary conditions, satisfying x 2 J(x )dx = 1. Proposition (Convergence of the discrete semigroup) P1/h −tλhk h Let gth (x , y ) = k=1 e vk (x )vkh (y ) and gt (x , y ) the heat semigroup. Then, ∀ t0 > 0 ∃ c(γ, t0 ) such that for all (t, x , y ) ∈ [t0 , ∞) × [0, 1]2 |gth (x , y ) − gt (x , y )| ≤ c(γ, t0 )h2−2ζ . Ingredients of the proof: Derive higher moment estimate R −3 JR (j)j 4 = o(h−2ζ ) via the bound P 1/h ζ−1 hX X −1 1 λhk . + o(h1−2ζ ) k=1 k=1 k2 1 (which gives ζ < 2 ), and use this to prove |λk − λhk | . h2−2ζ . Carina Geldhauser (Lund) Discrete SPDEs FAU-DCN 2021 13 / 23
Framework 1: Particle systems From discrete to continuous: the SPDE limit Results (informal summary) More involved interactions the scaling limit of the system with long-range interaction PR 1 j=−R JR (j) (ui+j (t) − ui (t)) mit R . N 2 und JR (j) ≈ 1 is the stochastic Allen-Cahn equation [Bovier, G. MPRF’17] the transition times of short-range and long-range system are comparable in the large N limit [MPRF’17] Nonlocal interactions need polynomial decay in the interaction strength (coefficients JR (j)), then they converge to ∆s , s ∈ ( 12 , 1) Wellposedness of the SPDE limit d = 1 proof by classical semigroup or variational techniques d > 1 depends on the noise. For “regular” noise as in d = 1, for additive space-time white noise by renormalization [DaPrato, Debussche ’02], [Hairer ’13], [Gubinelli, Imkeller, Perkowski ’13] Carina Geldhauser (Lund) Discrete SPDEs FAU-DCN 2021 14 / 23
Framework 2: Lattice Differential Equations Outline 1 Framework 1: Particle systems Scaling Limits From discrete to continuous: the SPDE limit 2 Framework 2: Lattice Differential Equations Traveling waves in the PDE model Lattice models Influence of stochastic noise Carina Geldhauser (Lund) Discrete SPDEs FAU-DCN 2021 14 / 23
Framework 2: Lattice Differential Equations Traveling waves in the PDE model Traveling waves in reaction-diffusion equations Nagumo / Schlögl equation For u(x , t) : R × R+ → R, consider ∂t u = ∆u − u(1 − u)(u − a) with parameter a ∈ R We observe: For each a ∈ (0, 12 ), there exists a travelling front solution v (η) ≥ 0 with v (−∞) = 0 and v (+∞) = 1, v 0 (η) > 0. Both the waves v (η) and their derivatives (∂η v )(η) decay exponentially to their asymptotic limits as η → ±∞. The wave speed s(a) < 0 is unique. Carina Geldhauser (Lund) Discrete SPDEs FAU-DCN 2021 15 / 23
Framework 2: Lattice Differential Equations Traveling waves in the PDE model Why a lattice model? electric signal jumps between gaps in myeline coating of nerve fibre Model signal propagation by a Lattice Differential Equation (LDE): solution ui at node i = electric potential at i-th myeline gap Carina Geldhauser (Lund) Discrete SPDEs FAU-DCN 2021 16 / 23
Framework 2: Lattice Differential Equations Traveling waves in the PDE model Semidiscrete reaction-diffusion equations Example: discrete-in-space Nagumo equation on lattice Z 1 ∂t ui = (ui+1 + ui−1 − 2ui ) + (1 − ui2 )(ui − a) h2 a ∈ [−1, 1] “excitable regime” traveling waves u(x , t) = u TW (x − ct) with speed c Figure: asymmetric reaction term f (u) := (u − 1)(u + 1)(u − a) “Pinning” phenomenon: if grid size h too large (depending on a), stationary solutions, maybe non-unique, speed c = 0. [Keener], others Carina Geldhauser (Lund) Discrete SPDEs FAU-DCN 2021 17 / 23
Framework 2: Lattice Differential Equations Lattice models A stochastic lattice model (Ω, F, (Ft )t , P) filtered probability space, noise is Q-Wiener on L2 (D) with covariance operator Q pos. semi-definite, symmetric, ∞ k=1 µk < ∞ P Space-discrete model: Stochastic Nagumo equation on a 1D lattice Z R X u̇i (t) = ν J(j) (ui+j (t) − ui (t)) + f (ui (t)) + g(ui (t))Bi (t) | {z } | {z } j=−R | {z } wave-type solutions unresolved dof synapse interaction Here, g : R → R comes from a multiplicative noise term, defined via (G(u)χ) (x ) := g(u(x ))χ(x ) for u, χ ∈ L2 (D) G(u) : L2 (D) → H, Lipschitz continuous, linear growth conditions. Simulation 1: Pulse in FitzHughNagumo eq., N=400, by Christian Kühn Simulation 2: Pulse in FitzHughNagumo eq., N=200, by Christian Kühn Carina Geldhauser (Lund) Discrete SPDEs FAU-DCN 2021 18 / 23
Framework 2: Lattice Differential Equations Influence of stochastic noise Result: stability of the wave in the semidiscrete model Informal idea: Assume that the noise acts on the transition part of the wave, i.e. g(0) = g(1) = 0. Compare our lattice solution with a deterministic reference wave Theorem (Stability of traveling waves (G. & Kuehn ’20)) Under suitable parameter conditions, and if the covariance of the noise is sufficiently small, the discrete-stochastic variant of the Nagumo equation has solutions u h , for which holds " # h TW P sup ku (t) − v (t)kL2 (R) > δ ≤ ε t∈[0,T ] for sufficiently small h and T < t∗ . Carina Geldhauser (Lund) Discrete SPDEs FAU-DCN 2021 19 / 23
Framework 2: Lattice Differential Equations Influence of stochastic noise Remarks The probability that t∗ is infinite depends on the initial error kv0 − v TW (0)k and on the covariance operator of the noise term. Breakdown of the wave (i.e. t∗ finite) depends on the initial error kv0 − v TW (0)k and on the covariance The smaller the covariance operator of the noise term kQk2HS , the smaller the probability for t∗ being finite. zero covariance does not imply that the noise strength is zero, but just that it is constant, and so it affects the solution only by a shift of c · t, which does not destroy the traveling wave property. Restrictions The result covers only the case where there is no pinning, i.e the grid is fine enough, due to the need of a deterministic reference wave For non-trace-class noise, need other techniques Carina Geldhauser (Lund) Discrete SPDEs FAU-DCN 2021 20 / 23
Framework 2: Lattice Differential Equations Influence of stochastic noise Overview: front propagation in 1D, discretization, noise Influence of discretization (on the deterministic equation) Continuous equation: Existence of traveling wave solutions u(x , t) = u(x − ct) with limξ→±∞ u(ξ) = ±1 . Speed c Semidiscrete equation: solution profile might change shape, be step-like (”lurching” in the motion of the interface), slow down or fail to propagate (space-discrete), speed up (time-discrete) Fully discrete equation: nonuniqueness of the pair wave speed - solution profile Influence of noise on the space-discrete model Stability of traveling waves −→ TODAY changes to speed and form of traveling wave solutions? −→ ongoing Carina Geldhauser (Lund) Discrete SPDEs FAU-DCN 2021 21 / 23
Framework 2: Lattice Differential Equations Influence of stochastic noise Ongoing work: speed close to pinning Maths observation: “Pinning” phenomenon: if grid size h too large (depending on a), stationary solutions, maybe non-unique, speed c = 0. [Keener ’87], many many others Simulations done in a deterministic lattice model: Figure: Shape (left) and speed (right) of deterministic traveling wave φ. Autor: H.J. Hupkes Ongoing work: Investigate speed of the wave as h approaches the critical value h(a), with S. Tikhomirov (St. Petersburg) and H.J. Hupkes (Leiden) Carina Geldhauser (Lund) Discrete SPDEs FAU-DCN 2021 22 / 23
Framework 2: Lattice Differential Equations Influence of stochastic noise References A. Bovier and C. Geldhauser. The scaling limit of a particle system with long-range interaction. Markov Proc. Rel. Fields 2017. C. Geldhauser and Ch. Kuehn. Travelling waves for discrete stochastic bistable equations. https://arxiv.org/abs/2003.03682 2020. N. Berglund and B. Gentz. Sharp estimates for metastable lifetimes in parabolic SPDEs: Kramers’ law and beyond. Electron. J. Probab., 2013. W. Stannat Stability of travelling waves in stochastic Nagumo equations. https://arxiv.org/abs/1301.6378 2013. Carina Geldhauser (Lund) Discrete SPDEs FAU-DCN 2021 23 / 23
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