Universität des Saarlandes. Fachrichtung 6.1 Mathematik

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1 Universität des Saarlandes U N I V E S I T A S S A A V I E N I S S Fachrichtung 6.1 Mathematik Preprint Nr. 309 Subsonic phase transition waves in bistable lattice models with small spinodal region Michael Herrmann, Karsten Matthies, Hartmut Schwetlick and Johannes Zimmer Saarbrücken 01

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3 Fachrichtung 6.1 Mathematik Preprint No. 309 Universität des Saarlandes submitted: June 1, 01 Subsonic phase transition waves in bistable lattice models with small spinodal region Michael Herrmann Universität des Saarlandes, Fachrichtung Mathematik Karsten Matthies University of Bath, Department of Mathematical Sciences Hartmut Schwetlick University of Bath, Department of Mathematical Sciences Johannes Zimmer University of Bath, Department of Mathematical Sciences

4 Edited by F 6.1 Mathematik Universität des Saarlandes Postfach Saarbrücken Germany Fax: preprint@math.uni-sb.de WWW:

5 Subsonic phase transition waves in bistable lattice models with small spinodal region Michael Herrmann, Karsten Matthies, Hartmut Schwetlick, Johannes Zimmer June 1, 01 Abstract Phase transitions waves in atomic chains with double-well potential play a fundamental role in materials science, but very little is known about their mathematical properties. In particular, the only available results about waves with large amplitudes concern chains with piecewise-quadratic pair potential. In this paper we consider perturbations of a bi-quadratic potential and prove that the corresponding three-parameter family of waves persists as long as the perturbation is small and localised with respect to the strain variable. More precisely, we introduce an anchor-corrector ansatz, characterise the corrector as a fixed point of a nonlinear and nonlocal operator, and show that this operator is contractive in a small ball of a certain function space. Keywords: MSC 010): phase transitions in lattices, heteroclinic travelling waves, FPU-type chains, kinetic relations 37K60, 47H10, 74J30, 8C6 Contents 1 Introduction Overview and main result Preliminaries and reformulation of the problem 5.1 eformulation as integral equation Transformation to the special case I δ = Proof of the existence and uniqueness result Inversion formula for M Solution operator to the linear subproblem Properties of the nonlinear operator G Fixed point argument Change in the kinetic relation 13 1 Introduction Many standard models in one-dimensional discrete elasticity describe the motion in atomic chains with nearest neighbour interactions. The corresponding equation of motion reads ü j t) = Φ u j+1 t) u j t)) Φ u j t) u j 1 t)), 1) where Φ is the interaction potential and u j denotes the displacement of particle j at time t. Of particular importance is the case of non-convex Φ, because then 1) provides a simple dynamical model for martensitic phase transitions. In this context, a propagating interface can be michael.herrmann@math.uni-sb.de, Universität des Saarlandes k.matthies@maths.bath.ac.uk, University of Bath h.schwetlick@maths.bath.ac.uk, University of Bath zimmer@maths.bath.ac.uk, University of Bath 1

6 described by a phase transition waves, which is a travelling wave that moves with subsonic speed and is heteroclinic as it connects periodic oscillations in different wells of Φ. The interest in such waves is also motivated by the quest to derive selection criteria for the naïve continuum limit of 1), which is the PDE tt u = x Φ x ). This equation is ill-posed for nonconvex Φ due to its elliptic-hyperbolic nature, and one proposal is to select solutions by so-called kinetic relations [AK91, Tru87] derived from travelling waves in atomistic models. Combining the travelling wave ansatz u j t) = Uj ct) with 1) yields the delay-advancedifferential equation c x) = 1 Φ x)), ) where x) := Ux + 1/) Ux 1/) the symmetrised) discrete strain profile and 1 F x) := F x + 1) F x) + F x 1). Periodic and homoclinic travelling waves have been studied intensively, see [FW94, SW97, FP99, Pan05, Her10] and the references therein, but very little is known about heteroclinic waves. The authors are only aware of [H10, Her11], which prove the existence of supersonic heteroclinic waves, and the small amplitude results from [Ioo00]. In particular, there seems to be no result that provides phase transitions waves with large amplitudes for generic doublewell potentials. Phase transition waves with large amplitudes are only well understood for piecewise quadratic potentials, and there exists a rich body of literature on bi-quadratic potentials, starting with [BCS01a, BCS01b], or tri-quadratic potentials [Vai10]. For the special case Φr) = 1 r r, Φ r) = r sgnr) 3) the existence of phase transition waves has been established by two of the authors using rigorous Fourier methods. In [SZ09] they consider subsonic speeds c sufficiently close to 1, which is the speed of sound, and show that ) admits for each c a two-parameter family of waves. These waves have exactly one interface and connect different periodic tail oscillations, see Figure for an illustration. In this paper we allow for small perturbations of the potential 3) and show that the phase transition waves from [SZ09] persist provided that the perturbation is sufficiently small and localised. Our approach is in essence perturbative and reformulates the travelling wave equation with perturbed potential in terms of a corrector profile S. The resulting equation can be written as MS = A GS) + η, 4) where η is a constant of integration. Moreover, M and A are linear integral operators and G a nonlinear superposition operator to be identified below. The analysis of 4) is rather delicate since the Fourier symbol of M has real roots. In our existence proof, we first eliminate the singularities and derive an appropriate inversion formula for M. Afterwards we introduce a class of admissible functions S and show that the properties of A and G guarantee that A GS) is compactly supported and sufficently small. These fine properties are illustrated in Fig. 4 and allow us to define a nonlocal and nonlinear operator T such that MT S) = A GS) + ηs) holds for all admissible S with some ηs). In the final step, we show that T is contractive in some ball of an appropriately defined function space. We further remark that each phase transition wave satisfies ankine-hugoniot conditions for the macroscopic averages of mass, momentum, and total energy [HSZ1], which imply nontrivial restrictions between the wave speed and the tail oscillations on both sides of the interface. Although these conditions do not appear explicitly in our existence proof, they can at least in principle) be computed because the tail oscillations are given by harmonic waves, see again Fig.. For general double-well potentials, however, it is much harder to evaluate the ankine-hugoniot conditions and thus it remains unclear which tail oscillations can be connected by phase transition waves. Closely related to the jump condition for the total energy is the kinetic relation, which specifies the transfer between oscillatory and non-oscillatory energy at the interface and determines the configurational

7 force that drives the wave. In the final section we discuss how the kinetic relation changes to leading order under small perturbation of the potential 3). We now present our main result in greater detail. 1.1 Overview and main result We study an atomic chain with interaction potential Φ δ r) = 1 r Ψ δ r), Ψ δ 0) = 0, where Ψ δ is a perturbation of Ψ 0 = sgn in a small neighbourhood of 0. The travelling wave equation therefore reads c = 1 Ψ δ ) ) 5) and depends on the parameters c and δ. In order to show that 5) admits solutions for small δ we rely on the following assumptions on Ψ δ, see Figure 1 for an illustration. Assumption 1. Let Ψ δ ) δ>0 be a one-parameter family of C -potentials such that i) Ψ δ coincides with Ψ 0 outside the interval δ, δ), ii) there is a constant C Ψ independent of δ such that for all r. The quantity Ψ δ r) CΨ, I δ := 1 Ψ δ r) C Ψ δ Ψ δ r) Ψ 0r) ) dr plays in important role in our perturbation result as it determines the leading order correction. Notice that our assumptions imply I δ = 1 δ δ Ψ δ r) dr = 1 Φ δ+1) Φ δ 1)) and hence I δ C Ψ δ. As already mentioned, the case δ = 0 has been solved in [SZ09]. The main result can be summarised as follows. Proposition [SZ09], Proof of Theorem 3.11). There exist 0 < c 0 < 1 such that for every c [c 0, 1), there exists a two-parameter family of solutions 0 W, ) to the travelling wave equation 5) with δ = 0 such that i) 0 0) = 0, ii) 0 D 0 1 c ) 1, iii) 0 x) > r 0 for x > x 0 and 0 x) < r 0 for x < x 0, iv) 0 x) > d 0 for x < x 0, for some constants x 0, r 0, d 0 and D 0 which depend only on c 0. For any such profile 0 there exists constants α ± and β ± such that lim ±rc + α ± 1 cos k c x)) + β ± sin k c x) 0 x) = 0, x ± where r c and k c > 0 are uniquely determined by c. Moreover, any two profiles 0 and 0 satisfy 0 0 span {sin k c ), 1 cos k c )}. 3

8 +1 0 r) + 1 r) r + + r r 1 1 Figure 1: Sketch of Ψ δ and Φ δ for δ = 0 grey) and δ > 0 black). Since Φ 0 is symmetric, I δ is just half the energy difference between the two wells of Φ δ. graph of Figure : Sketch of the waves for δ = 0 grey) and δ > 0 black) as provided by our perturbation result; the shaded region indicates the spinodal interval [ δ, +δ], where Ψ δ differs from Ψ 0. Both waves differ by the constant I δ = Oδ) and a small oscillatory corrector S of order O δ ). The tail oscillations of both waves do not penetrate the spinodal region and are generated by harmonic waves with wave number k c. Notice that the phase shifts, amplitudes, and local averages are different on both sides of the interface and depend on δ. The main result of this article can be described as follows. Theorem 3. For all c 1 c 0, 1) there exists δ 0 > 0 such that for any 0 < δ < δ 0, any speed c 0 < c < c 1, and any given wave 0 as in Proposition there exists a solution to 5) with where I δ = Oδ) and the corrector S W, ) i) vanishes at x = 0, ii) is small in the sense of = 0 I δ + S, S = Oδ ), S = Oδ), S = O1). Moreover, for small δ there exists only one with these properties. Concerning these assertions, we emphasise that: i) Our existence proof implies that different choices of 0 provide different waves, see Lemma 15. ii) All constants derived below depend on c 1 and c 0 but for notational simplicity we do not write this dependence explicitly. It remains open whether δ 0 can be chosen independently of c 1. iii) The surprisingly simple leading order effect, that is the addition of I δ to 0, implies that the kinetic relation does not change to order Oδ). Notice, however, that the kinetic relation depends on the choice of 0, cf. [SZ]. iv) The travelling wave equation 5) is, of course, invariant under shifts in x but fixing 0 and S at 0 removes neutral directions in the contraction proof. 4

9 This paper is organised as as follows. In we reformulate 5) in terms of integral operators A and M and show that it is sufficient to prove the existence of waves for the special case I δ = 0. In Section 3 we then study the equation for the corrector S. We first establish an inversion formula for M and investigate afterwards the properties of the nonlinear G. These result then allow us to establish the fixed point argument for the operator T. Finally, we discuss the kinetic relation in 4. Preliminaries and reformulation of the problem In this section we reformulate the travelling wave equation 5) in terms of integral operators and show that elementary transformations allow us to assume that I δ = 0 holds for all δ > 0..1 eformulation as integral equation For our analysis it is convenient to reformulate the problem in terms of the convolution operator A and the operator M defined by AF )x) := x+1/ F s) ds, MF := A F c F. x 1/ The travelling wave equation can then be stated as M = A Ψ δ ) + µ. 6) Lemma 4. A function W W, ) solves the travelling wave equation 5) if and only if there exists a constant µ such that, µ) solves 6). Proof. By definition of A, we have of M, equivalent to d A = dx 1. Equation 5) is therefore, and due to the definition M) = P, P := A Ψ δ ). 7) The implication 6) = 5) now follows immediately. Towards the reversed statement, we integrate 7) 1 twice with respect to x and obtain M = P + λx + µ, where λ and µ denote constants of integration. The condition L ) implies M, Ψ δ ), P L ), and we conclude that λ = 0. We next summarize some properties of the operator A. Lemma 5. For any 1 p we have A: L p ) W 1,p ) BC) with AF L p ) F L p ), AF ) L p ) F L p ), AF BC) F L p ) for all F L p ), where AF ) = F = F + 1 ) F 1 ). Moreover, supp F [x1, x ] implies supp AF [x 1 1, x + 1 ]. Proof. All assertions follow immediately from the definition of A and Hölder s inequality. Some of the arguments in our existence proof rely on Fourier transform in the space of tempered distributions), which we normalise as follows F k) = 1 π e ikx F x) dx, F x) = 1 π e ikx F k) dk. In particular, the operators A and M diagonalise in Fourier space and have symbols respectively. ak) = sin k/) k/ and mk) = ak) c, 5

10 . Transformation to the special case I δ = 0 The key observation that traces the general case I δ 0 back to the special case I δ = 0 is that any shift in Ψ δ can be compensated by adding a constant to. Lemma 6. The family Ψ δ) δ>0 defined by δ = δ1 + C Ψ ), Ψ δr) = Ψ δ r I δ) satisfies Assumption 1 with constant C Ψ = C Ψ 1 + C Ψ ) as well as Ψ δr) Ψ 0r) dr = 0 for all δ > 0. Ĩ δ = 1 Moreover, each solution, µ) to the modified travelling wave equation M = A Ψ δ ) + µ 8) defines a solution, µ) to 6) via = I δ and µ = µ c 1 ) I δ and vice versa. Proof. Due to I δ C Ψ δ and our definitions we find Ψ δr) = Ψ 0 r) at least for all r with r δ, as well as We also have Ψ δr) C Ψ C Ψ, Ĩ δ = 1 = 1 Ψ δr) C Ψ δ = C Ψ δ 1 + C Ψ 1 + C Ψ = C Ψ δ for all r. Ψ δ r I δ ) Ψ 0r) ) dr = 1 Ψ δ r) Ψ 0r + I δ ) ) dr Ψ δ r) Ψ 0r) ) dr + 1 Ψ 0 r) Ψ 0r + I δ ) ) dr = I δ I δ = 0. Finally, the equivalence of 6) and 8) is obvious. 3 Proof of the existence and uniqueness result We now show that for fixed c the two-parameter family of phase transitions for δ = 0 persists under the perturbation Ψ 0 Ψ δ provided that δ is sufficiently small. To this end we proceed as follows. i) We fix c with c 0 < c < c 1 < 1 with c 0 and c 1 as in Proposition and Theorem 3. Then there exists a unique solution k c > 0 to ak c ) = c, and this implies m±k c ) = 0, m ±k c ) 0, and mk) 0 for k ±k c. We emphasise again that all constants derived below can be chosen independently of c but are allowed to depend on c 0 and c 1. ii) Thanks to Proposition and Lemma 4, we fix 0, µ 0 ) from the two-parameter family of solutions to the integrated travelling wave equation 6) for δ = 0 and given c. ecall that 0 is normalised by 0 0) = 0. iii) In view of Lemma 6, we assume that I δ = 0 holds for all δ > 0. To avoid unnecessary technicalities we also assume from now on that δ is sufficiently small. In order to find a solution, µ) to the integrated travelling wave equation 6) for δ > 0, we further make the anchor-corrector ansatz = 0 + S, µ = µ 0 + η, 6

11 and seek correctors S, η) such that Here, the nonlinear operator G is defined by A natural ansatz space for S is given by MS = A G + η, G = GS). 9) GS)x) = Ψ δ 0 x) + Sx) ) Ψ 0 0 x) ). X := { S W, ) : S0) = 0 }, where we impose the constraint S0) = 0 in order to eliminate the non-uniqueness resulting from the shift invariance of the travelling wave equation 6). In fact, without this normalisation condition any corrector S provides a whole family of other possible correctors via S = S + x 0 ) x 0 ) 0 with x 0 = Oδ ). 3.1 Inversion formula for M Our first task is to construct for given G a solution S, η) to the affine equation 9) 1. In a preparatory step, we therefore derive an appropriate inversion formula for the operator M. ecall that there does not exist a unique inverse of M as the corresponding Fourier symbol, which is the function m, has real roots at k = ±k c. graph of Y i graph of MY i graph of b Y i k c +k c Figure 3: Properties of Y 1 grey) and Y black). As illustrated in Figure 3, we introduce two functions Y 1, Y L ) by π π Y 1 x) := m k c ) cos k cx)sgnx), Y x) := m k c ) sin k cx)sgnx), and verify by direct computations the following assertions. emark 7. We have i) MY i L ) with supp MY i [ 1, 1], ii) Ŷ1k) = + i k m k c ) k kc iii) mŷi L ) BC 1 ) with k c and Ŷ k) = m k c ) k kc, lim k ±k c mk)ŷ1k) = ±i and lim k ±k c mk)ŷk) = 1. Using Y 1 and Y, we can establish the following linear and continuous inversion formula for M. Lemma 8. Let Q be given with Q L ) BC 1 ). Then there exists Z L ), which depends linearly on Q, such that M Z i Q+k c ) Q k c ) Y 1 Q+k c ) + Q k ) c ) Y = Q, 10) 7

12 and Z D Q + Q ) 1, for some constant D independent of Q. Proof. Thanks to our assumptions on Q and the properties of m and Y 1,, the function Z L ) is well defined by Ẑk) := Qk) + i Q+k c ) Q k c ) mk)ŷ1k) + Q+k c ) + Q k c ) mk)ŷk) mk) L ) BC) and satisfies 10) by construction. Moreover, with J := [ k c, +k c ] we readily verify the estimates Ẑ L \J) m 1 L \J) Q L \J) + Q+kc ) + Q kc ) ) ) Ŷ1 L \J) + Ŷ L \J) D Q L ) + Q ) BC) and Ẑ CJ) D Q C 1 J). We note that the constant D in Lemma 8 is uniform in c 0 < c < c 1 but will grow with c 1 1, due to the definition of Y 1 and Y and the properties of m. 3. Solution operator to the linear subproblem We are now able to prove that the affine problem 9) 1 has a nice solution operator on the space of all compactly supported functions G. Lemma 9. Let G L ) be given, with supp G [ 1, 1]. Then there exist S X and η, both depending linearly on G, such that Moreover, we have i) η C M A G, ii) S C M A G, iii) S C M AG, iv) S C M G. for some constant C M > 0 independent of G. MS = A G + η. Proof. The function Q := A G satisfies supp Q [, ], and using Qk) + as well as Q = Q, we easily verify that d dk Qk) C ) 1 + x Qx) dx C Q L ) Q + Q 1, C Q. Using Lemma 8, we now define S := Z + f 1 Y 1 + f Y such that M S = Q, where Z L ), and Z + f 1 + f C Q = C A G. 11) 8

13 By definition of M, Q, and S we have and the properties of A imply c S = A G + A S = A G + A Z + f 1 Y 1 + f Y ), 1) A Z Z, A Y i Y i. Combining these estimates with 11) and 1), we arrive at S L ) with S C A G. Moreover, differentiating the first identity in 11) with respect to x, we get c S = AG + A S ), c S = G + S ), where the discrete differential operator is defined as U = U + 1 ) U 1 ), cf. Lemma 5. This implies S C AG, S C G thanks to A G AG G and A S S. We finally define Sx) = Sx) S0) and η = 1 c ) S0). All assertions now follow by taking CM as the maximum of all constants C in this proof. While we will work in a subset of W,, we remark that the regularity of the equation Lemma 9 iv)) would allow us to start the iteration with S W 1,. 3.3 Properties of the nonlinear operator G We say that S X is δ-admissible if there exist two number x < 0 < x +, which both depend on S and δ, such that i) 0 x ± ) + Sx ± ) = ±δ, ii) 0 x) + Sx) < δ for x < x, iii) 0 x) + Sx) > +δ for x > x +, iv) 1 0 0) < 0 x) + S x) < 0 0) for x < x < x +, Notice that the properties of 0 implies that the set of admissible correctors is not empty for all sufficiently small δ. We are now able to derive the second key argument for our fixed-point argument. Lemma 10. Let S be δ-admissible and G = GS). Then we have G D, supp G [ Dδ, Dδ], Gx) dx D 1 + S ) δ for some constant D independent of S and δ. Proof. The first assertion is a consequence of G 1 + C Ψ. Since S is δ-admissible, we have supp G = [x, x + ], ±δ = ± x± 0 0 x) + S x) ) dx 9

14 with x ± as above, and this implies 1 0 0)δ x ± supp G δ]. 13) 0)δ, 0)[ δ, 0 Using the Taylor estimate 0x) + S x) 00) S 0) 0 + S ) x, 14) we also verify that x δ ± 0 0) + S 0) x ± A direct computation now yields Gx) dx = x+ x 0 + S 0 0) + S 0) 0 4δ 0 + S 0 0)3. 15) Ψ δ 0 x) + Sx) ) x+ δ dx sgnx) dx = Ψ dr δ r) x δ zr) x + + x, 16) where z 0 x) + Sx)) = 0 x) + S x) for all x [x, x + ]. Thanks to 14), our assumption I δ = +δ δ Ψ δ r) dr = 0, and the estimate zr), z0) 1 0 0) we get δ δ Ψ dr δ δ r) zr) δ Ψ δ r) zr) z0) x+ + x ) 0 dr Dδ + S ). zr)z0) 0 0) and combining this with 13), 15) and 16) gives Gx) dx 0 + S Dδ. 17) 0 0)3 By Proposition iv), 0 0) is bounded from below. Moreover, combining Proposition ii) with the equation for 0, that is c 0 = sgn, we find a constant D, which depends only on c 0 and c 1, such that 0 D. The second and third assertion are now direct consequences of these observations and the estimates 15) and 17). Corollary 11. There exists a constant C G, which is independent of δ, such that holds with G = GS) for all δ-admissible S. AG C G δ, A G C G 1 + S ) δ, Proof. Thanks to Lemma 10 and the properties of A, we find some constant D such that AGx) Dδ for x ± 1 Dδ AGx) = Gx) dx for x 1 Dδ, AGx) = 0 for x 1 + Dδ, see Figure 4 for an illustration. The first estimate is now a consequence of the trivial estimate Gx) dx supp G G Dδ, whereas the second one follows from A G ) x) Dδ + and the refined estimate Gx) dx D1 + S )δ. Gx) dx for all x 10

15 graph of G graph of AG graph of A G O1) O ) O ) O ) Figure 4: Properties of G = GS) for δ admissible S. The shaded regions indicate intervals with length of order Oδ). In the general case I δ 0, one finds due to Gx) dx = I δ + Oδ ) the weaker estimate A G D1 + S )δ. This bound is still sufficient to establish a fixed point argument, but provides only a corrector S of order Oδ). ecall, however, that Lemma 6 shows that shifting Ψ δ and changing 0 allows us to find correctors of order Oδ ) even in the case I δ 0. We finally derive continuity estimates for G. Lemma 1. There exists a constant C L independent of δ such that A G 1 A G + AG 1 AG + δ G 1 G C L δ S 1 S + δ S 1 S ) holds for all δ-admissible correctors S 1 and S with G l = GS l ). Proof. According to Lemma 10, there exists a constant D, such that G l x) = 0 for all x with x Dδ. For x Dδ, we use Taylor expansions for S 1 S at x = 0 to find S x) S 1 x) S S 1 x + S S 1 x, where we used that S 0) S 1 0) = 0. Combining this estimate with the upper bounds for Ψ δ gives G1 x) G x) D S1 x) S x) D S δ 1 S + δ S 1 S ), and hence the desired estimate for G G 1. We also have A G 1 A G AG 1 AG suppg G 1 ) G G 1 Dδ G G 1, and this completes the proof. 3.4 Fixed point argument Now we have prepared all ingredients to establish a suitable fixed point argument in the space } X δ := {S X : S C 0 δ, S C 1 δ, S C with constants C := C M 1 + C Ψ ), C 1 := C M C G, C 0 := C M C G 1 + C ). Lemma 13. For all sufficiently small δ there exists an operator such that for any S X δ we have for some ηs) with ηs) C 0 δ. T : X δ X δ MT S) = A GS) + ηs) 11

16 Proof. Step 1: We first show that each S X δ is δ-admissible provided that δ is sufficiently small. According to Proposition, there exist positive constants r 0, x 0, and d 0 such that 0 x) r 0 for x > x 0, d 0 < 0x) for x < x 0, and combining the upper estimate for 0 with the equation for 0 we find 0 D for some constant D. We now set δ 0 := 1 min { d 0 D d 0 + C 1, x 0 d 0, } r0, r 0, x δ := δ C 0 d 0 and assume that δ < δ 0. For any x with x x δ x 0, we then estimate 0x) + S x) 00) D x δ + C 1 δ D d 0 + C 1 )δ 1 d 0 < 1 00), and this gives 1 0 0) 0 x) + S x) 3 0 0). Moreover, x δ x x 0 implies 0 x) + Sx) x 0s) ds S x d 0 C 1 δ) x > 1 d 0 δ = δ, d 0 0 whereas for x > x 0 we find 0 x) + Sx) r 0 C 1 δ 1 r 0 δ. Using x := max{x : 0 x) + Sx) δ}, x + := min{x : 0 x) + Sx) +δ}, we now easily verify that S is δ-admissible. Step : We next show that X δ is invariant under T for δ < δ 0. Since each S X δ is δ-admissible, Corollary 11 yields AGS) C G δ, A GS) C G 1 + C )δ, and GS) 1 + C Ψ holds by definition of G and Assumption 1. Lemma 9 now provides T S) and ηs), as well as the estimates T S) C M C G 1 + C )δ = C 0 δ, T S) C M C G δ = C 1 δ, T S) C M 1 + C Ψ ) = C, and ηs) C 0 δ. In particular, we have T S) X δ. Theorem 14. For sufficiently small δ, the operator T has a unique fixed point in X δ. Proof. We equip X δ with the norm S # = S + S +δ S, which is, for fixed δ, equivalent to the standard norm. For given S 1, S X δ, we now employ the estimates from Lemma 9 and Lemma 1. This gives ) T S ) T S 1 ) # C M A GS ) A GS 1 ) + AGS ) AGS 1 ) + δ GS ) GS 1 ) C M C L δ S S 1 #, and we conclude that T is contractive with respect to # provided that δ < 1/C M C L ). The claim is now a direct consequence of the Banach Fixed Point Theorem. We now show that different anchors provide different waves. 1

17 Lemma 15. Let 0, µ 0 ) and 0, µ 0 ) be two different travelling waves for δ = 0 and the same value of c, and S, η) and S, η) be the corresponding correctors provided by Theorem 14. Then 0 + S 0 and 0 + S are different. Proof. By construction, we have while Proposition guarantees that The claim now follows since U 1 U = {0}. 4 Change in the kinetic relation S, S U 1 := span {Y 1, Y, 1} L ), 0 0 U := span {sin k c ), 1 cos k c )}. In this final section we show that the kinetic relation does not change to order Oδ). To this end we denote by δ a travelling wave solution to ) as provided by Theorem 3. The corresponding configurational force, cf. [HSZ1], is then defined by Υ δ := Υ e,δ Υ f,δ with Υ e,δ := Φ δ r δ,+ ) Φ δ r δ, ), Υ f,δ := Φ δ r δ,+) + Φ δ r ) δ, ) r δ,+ r δ,, where the macroscopic strains r δ,± on both sides of the interface can be computed from δ via 1 r δ,± = lim L L +L 0 δ ±x) dx. Lemma 16. Let δ be a travelling wave from Theorem 3, and 0 the corresponding wave for δ = 0. Then we have Υ δ = Υ 0 + Oδ ). Proof. By construction, we know that the only asymptotic contributions to the profile δ are due to 0 I δ plus a small asymptotic corrector of order Oδ ) from span{1, Y 1, Y }. This implies r δ,± = r 0,± I δ + Oδ ). As r 0,± and r δ,± are both larger than δ we know that Thus, we conclude and hence Moreover, we calculate Υ e,δ = = rδ,+ Φ δ r δ, rδ,+ r δ, Ψ δ r δ,±) = 1 = Ψ 0 r δ,± ). Φ δ r δ,±) = r δ,± 1 = Φ 0 r 0,± ) I δ + Oδ ), Υ f,δ = Υ f,0 I δ r 0,+ r 0, ) + Oδ ). r) dr = Φ 0r) dr rδ,+ r δ, rδ,+ r δ, r Ψ δ r) Ψ 0r) + Ψ 0r) ) dr Ψ δ r) Ψ 0r) ) dr = Φ 0 r δ,+ ) Φ 0 r δ, ) I δ = 1 r δ,+ 1) 1 r δ, + 1) I δ = 1 r 0,+ I δ 1) 1 r 0, I δ + 1) I δ + Oδ ) = 1 r 0,+ 1) 1 r 0, + 1) I δ r 0,+ 1 r 0, 1) I δ + Oδ ) = Υ e,0 I δ r 0,+ r 0, ) + Oδ ). Subtracting both results gives Υ δ = Υ 0 + Oδ ), the desired result. 13

18 Acknowledgement The authors gratefully acknowledge financial support by the EPSC EP/H0503X/1). eferences [AK91] ohan Abeyaratne and James K. Knowles. Kinetic relations and the propagation of phase boundaries in solids. Arch. ational Mech. Anal., 114): , [BCS01a] Alexander M. Balk, Andrej V. Cherkaev, and Leonid I. Slepyan. Dynamics of chains with non-monotone stress-strain relations. I. Model and numerical experiments. J. Mech. Phys. Solids, 491): , 001. [BCS01b] Alexander M. Balk, Andrej V. Cherkaev, and Leonid I. Slepyan. Dynamics of chains with non-monotone stress-strain relations. II. Nonlinear waves and waves of phase transition. J. Mech. Phys. Solids, 491): , 001. [FP99] G. Friesecke and. L. Pego. Solitary waves on FPU lattices. I. Qualitative properties, renormalization and continuum limit. Nonlinearity, 16): , [FW94] Gero Friesecke and Jonathan A. D. Wattis. Existence theorem for solitary waves on lattices. Comm. Math. Phys., 161): , [Her10] [Her11] [H10] Michael Herrmann. Unimodal wavetrains and solitons in convex Fermi-Pasta-Ulam chains. Proc. oy. Soc. Edinburgh Sect. A, 1404): , 010. Michael Herrmann. Action minimising fronts in general FPU-type chains. J. Nonlinear Sci., 11):33 55, 011. Michael Herrmann and Jens D. M. ademacher. Heteroclinic travelling waves in convex FPU-type chains. SIAM J. Math. Anal., 44): , 010. [HSZ1] Michael Herrmann, Hartmut Schwetlick, and Johannes Zimmer. On selection criteria for problems with moving inhomogeneities. Contin. Mech. Thermodyn., 4:1 36, /s [Ioo00] Gérard Iooss. Travelling waves in the Fermi-Pasta-Ulam lattice. Nonlinearity, 133): , 000. [Pan05] Alexander Pankov. Travelling waves and periodic oscillations in Fermi-Pasta-Ulam lattices. Imperial College Press, London, 005. [SW97] D. Smets and M. Willem. Solitary waves with prescribed speed on infinite lattices. J. Funct. Anal., 1491):66 75, [SZ] [SZ09] [Tru87] [Vai10] Hartmut Schwetlick and Johannes Zimmer. Kinetic relations for a lattice model of phase transitions. evision submitted to Archive for ational Mechanics and Analysis. Preprint: Hartmut Schwetlick and Johannes Zimmer. Existence of dynamic phase transitions in a one-dimensional lattice model with piecewise quadratic interaction potential. SIAM J. Math. Anal., 413): , 009. L. M. Truskinovskiĭ. Dynamics of nonequilibrium phase boundaries in a heat conducting non-linearly elastic medium. Prikl. Mat. Mekh., 516): , Anna Vainchtein. The role of spinodal region in the kinetics of lattice phase transitions. J. Mech. Phys. Solids, 58):7 40,

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