Inverse Problems and Regularization An Introduction

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1 Inverse Problems and Regularization An Introduction Stefan Kindermann Industrial Mathematics Institute University of Linz, Austria

2 What are Inverse Problems? One possible definition [Engl, Hanke, Neubauer 96]: Inverse problems are concerned with determining causes for a desired or an observed effect. Cause (Parameter, Unknown, Solution of Inv. Prob,...) Direct Problem = Inverse Problem = Effect (Data, Observation,...)

3 Direct and Inverse Problems The classification as direct or inverse is in the most cases based on the well/ill-posedness of the associated problems: Cause Stable = Unstable = Effect Inverse Problems Ill-posed/(Ill-conditioned) Problems

4 What are Inverse Problems? A central feature of inverse problems is their ill-posedness Well-Posedness in the sense of Hadamard [Hadamard 23] Existence of a solution (for all admissible data) Uniqueness of a solution Continuous dependence of solution on the data Well-Posedness in the sense of Nashed [Nashed, 87] A problem is well posed if the set of Data/Observations is a closed set. (The range of the forward operator is closed).

5 Abstract Inverse Problem Abstract inverse problem: Solve equation for x X (Banach/Hilbert-... space), given data y Y (Banach/Hilbert-... space) F (x) = y, where F 1 does not exist or is not continuous. F... forward operator We want x = F 1 (y) x.. (generalized) solution

6 Abstract Inverse Problem If the forward operator is linear linear inverse problem. A linear inverse problem is well-posed in the sense of Nashed if the range of F is closed. Theorem: An linear operator with finite dimensional range is always well-posed (in Nashed s sense). Ill-posedness lives in infinite dimensional spaces

7 Abstract Inverse Problem Ill-posedness lives in infinite dimensional spaces Problems with a few number of parameters usually do not need regularization. Discretization acts as Regularization/Stabilization Ill-posedness in finite dimensional space Ill-conditioning Measure of ill-posedness: decay of singular values of forward operator

8 Methodologies in studying Inverse Problems Deterministic Inverse Problems (Regularization, worst case convergence, infinite dimensional, no assumptions on noise) Statistics (Estimators, average case analysis, often finite dimensional, noise is random variable, specific structure ) Bayesian Inverse Problems (Posteriori distribution, finite dimensional, analysis of post. dist. by estimators, specific assumptions on noise and prior) Control Theory (x= control, F (x)= state, convergence of state not control, infinite dimensional, no assumptions)

9 Deterministic Inverse Problems and Regularization Try to solve when F (x) = y, x = F 1 (y) does not exist. Notation: x the true (unknown) solution (minimal norm solution) Even if F 1 (y) exists, it might not be computable [Pour-El, Richards 88]

10 Deterministic Inverse Problems and Regularization Data noise: Usually we do not have the exact data y = F (x ) but only noisy data y δ = F (x ) + noise Amount of noise: noiselevel δ = F (x ) y δ

11 Deterministic Inverse Problems and Regularization Method to solve Ill-posed problems: Regularization: Approximate the inverse F 1 by a family of stable operators R α F (x) = y x = F 1 (y) x α = R α (y) R α F 1 R α Regularization operators α Regularization parameter

12 Regularization α small R α good approximation for F 1, but unstable α large R α stable but bad approximation for F 1, α... controls Trade-off between approximation and stability. Total error = approximation error + propagated data error x α x Total Error Approximation Error Propagated Data Error α How to select α: Parameter choice rules

13 Example: Tikhonov Regularization Tikhonov Regularization: [Phillips 62; Tikhonov 63] Let F : X Y be linear between Hilbertspaces: A least squares solution to F (x) = y is given by the normal equations F Fx = F y Tikhonov regularization: Solve regularized problem F Fx + αx = F y x α = (F F + αi ) 1 F y

14 Example: Tikhonov Regularization Error estimates (under some conditions) δ 2 x α x 2 + Cα ν α total Error (Stability) Approx. Theory of linear and nonlinear problems in Hilbert spaces: [Tikhonov, Arsensin 77; Groetsch 84; Hofmann 86; Baumeister 87, Louis 89; Kunisch, Engl, Neubauer 89; Bakushinskii, Goncharskii 95; Engl, Hanke, Neubauer 96; Tikhonov, Leonov, Yagola 98;... ]

15 Example: Landweber iteration Landweber iteration [Landweber 51] Solve normal equation by Richardson iteration Landweber iteration x k+1 = x k F (F (x k ) y) k = 0,... Iteration index is the regularization parameter α = 1 k

16 Example: Landweber iteration Error estimates (under some conditions) x k x 2 C kδ + k ν total Error (Stability) Approx. Semiconvergence Iterative Regularization Methods: Parameter choice = choice of stopping index k Theory: [Landweber 51; Fridman 56; Bialy 59; Strand 74; Vasilev 83; Groetsch 85; Natterer 86; Hanke, Neubauer, Scherzer 95; Bakushinskii, Goncharskii 95; Engl, Hanke, Neubauer 96;... ]

17 Notion of Convergence Does the regularized solution converges to the true solution as the noise level tends to 0 (Worst case) convergence lim x α x δ 0 lim sup{ x α x y δ : y δ F (x ) δ} = 0 δ 0 (for a given parameter choice rule) Convergence in expectation E x α x 2 0 as E y δ F (x ) 2 0

18 Theory of Regularization of Inverse Problems Convergence depends on x Question of speed: convergence rates x α x f (α) or x α x f (δ)

19 Theoretical Results [Schock 85]: Convergence can be arbitrarily slow! Theorem: For ill-posed problems in the sense of Nashed, there cannot be a function f with lim δ f (δ) = 0 such that for all x x α x f (δ) Uniform bounds on the convergence rates are impossible Convergence rates are possible if x in some smoothness class

20 Theoretical Results Convergence rates: requires a source condition x M Convergence rates modulus of continuity of the inverse Ω(δ, M) = sup{ x 1 x 2 F (x 1) F (x 2) δ, x 1, x 2 M} Theorem[Tikhonov, Arsenin 77, Morozov 92, Traub, Wozniakowski 80] For an arbitrary regularization map, arbitrary parameter choice rule (with R α (0) = 0) x α x Ω(δ, M)

21 Theoretical Results Standard smoothness classes: For linear ill-posed problems in Hilbert spaces we can form M = X µ = {x = (F F ) ν ω ω X } (Hölder) source condition (=abstract smoothness condition) Ω(δ, X µ ) = Cδ 2µ 2µ+1 Best convergence rate for Hölder source conditions A regularization operator and a parameter choice rule such that is called order optimal. x α x = Cδ 2µ 2µ+1

22 Theoretical Results Special case x = F ω Such source conditions can be generalized to nonlinear problems e.g. x = F (x ) ω x = (F (x ) F (x )) ν ω

23 Theoretical Results Many regularization method have shown to be order optimal. A significant amount of theoretical results in regularization theory deals with this issue: Convergence of method and parameter choice rule Optimal order convergence under source condition. Knowledge of the source condition does not have to be known.

24 Parameter Choice Rules How to choose the regularization parameter: Classification a-priori α = α(δ) a-posteriori α = α(δ, y) heuristic α = α(y)

25 Bakushinskii veto Bakushinskii veto: [Bakushinskii 84] A parameter choice without knowledge of δ cannot yield a convergent regularization in the worst case (for ill-posed problems). Knowledge of δ is needed! heuristic parameter choice rules are nonconvergent in the worst case

26 a-priori-rules Example of a-priori rule: If x X µ, then α = δ 1 2µ+1 yields optimal order for Tikhonov regularization + Easy to implement Needs information on source condition

27 a-posteriori rules Example a-posteriori rules: Morozov s Discrepancy principle: [Morozov 66] Fix τ > 1, DP: Choose the largest α such that the residual is of the order of the noise level F (x α ) y τδ Yields in many situations a optimal order method + Easy to implement + No information on source conditions In some cases not optimal order Other a-posteriori choice rules: Gferer-Raus-Rule (improved discrepancy principle) [Raus 85; Gferer 87] Balancing principle [Lepski 90; Mathe, Pereverzev 03]...

28 Heuristic Parameter Choice rules Example heuristic rules: Quasi-optimality Rule [Tikhonov, Glasko 64] Choose a sequence of geometrically decaying regularization parameter α n = Cq n q < 1 For each α compute x αn Choose α = α n where n is the minimizer of x αn+1 x αn

29 Heuristic Parameter Choice rules Example heuristic rules: Hanke-Raus Rule [Hanke, Raus 96] Choose α as minimizer of 1 α F (x α ) y

30 Heuristic Parameter Choice rules: Theory Heuristic Rules cannot converge in the worst case: Convergence in the restricted noise case [K., Neubauer 08, K. 11] lim x α x 0 δ 0 if y δ = F (x) + noise, noise N The condition is an abstract noise condition. noise N

31 Heuristic Parameter Choice rules: Theory In the linear case reasonable noise conditions can be stated and convergence and convergence rates can be shown: Noise condition: Data noise has to be sufficiently irregular

32 Nonlinear Case :Tikhonov Regularization with F nonlinear F (x) = y Tikhonov Regularization for Nonlinear Problems [Tikhonov, Arsenin 77; Engl, Kunisch Neubauer, 89; Neubauer 89,... ] x α is a (global) minimizer of the Tikhonov functional J(x) = F (x) y 2 + αr(x) R(x) is a regularization functional

33 Nonlinear Case :Tikhonov Regularization Convergence (Rates) Theory: Hilbert spaces [Engl, Kunisch Neubauer 89; Neubauer 89] Banach spaces [Kaltenbacher, Hofmann, Pöschl, Scherzer 08] Parameter Choice rules: a-priori: α = δ ξ a-posteriori: Discrepancy principle

34 Nonlinear Case :Tikhonov Regularization Examples: Sobolev norm R(x) = x 2 H s Total Variation L 1 -norm R(x) = R(x) = x x Maximum Entropy R(x) = x log(x)

35 Nonlinear Case :Tikhonov Regularization Choice of the Regularization functional: Deterministic Theory: User can choose: Should stabilize problem Convergence theory should apply R(x) should reflect what we expect from solution Bayesian viewpoint: Regularization functional prior

36 Nonlinear Case :Tikhonov Regularization Computational issue: The regularized solution is a global minimum of a optimization problem x α is a (global) minimizer J(x) = F (x) y 2 + αr(x)

37 Iterative Methods Example: Nonlinear Landweber iteration [Hanke, Neubauer, Scherzer 95] x k+1 = x k F (x k ) (F (x k ) y) Parameter choice by choosing the stopping index. Convergence rates theory needs a nonlinearity condition F (x) F (x ) F (x )(x x ) C F (x) F (x ) Restricts the nonlinearity of the problem Variants of a nonlinearity condition Range-invariance [Blaschke/Kaltenbacher 96] Curvature condition [Chavent, Kunisch 98] Variational inequalities [Kaltenbacher, Hofmann, Pöschl, Scherzer 08] Faster alternative: Gauss-Newton type iterations [Bakushinskii 92, Blaschke, Neubauer, Scherzer 97]

38 Summary Theoretical issues: For a given inverse problem Understand ill-posedness (Uniqueness/Stability) Are data rich enough to characterize solution uniquely How unstable is the inverse problem (degree of ill-posedness) Method of Regularization + Parameter Choice Design efficient regularization method for class of problem Convergence, Convergence rates (optimal order), Interplay: Regularization, Discretization Practical issues: How to compute global optimum in TR (efficiently) Improving iterative methods (Newton-type, preconditioning) What Regularization term to choose

39 Dynamic Inverse Problems Forward operator/solution x(t) depend on time F (x(t t), t) = y(t)

40 Dynamic Inverse Problems Examples: Volterra integral equation of the first kind t Parameter identification in ODEs 0 k(t, s)x(s)ds = y(t) y (t) = f (t, y(t), x(t)) Control theory z(t) = Az(t) + Bx(t) y(t) = Cz(t) + Dx(t)

41 Methods Example: Tikhonov Regularization T 0 + Convergence F (t, x(., t)) y(t) 2 dt + αr(x(t) Not causal/sequential: Computation of x(t) requires all data (past/future)

42 Methods Alternative: Dynamic Programing [K.,Leitao 06] + Convergence Only for linear problems x (t) = G(x(t), V (t)) Partially causal/sequential: Computation of V (t) requires all data (past/future)

43 Methods Control Theoretic Methods: Feedback control x(t) = Ky(t) (x(t), x (t)) = Ky(t) Convergence in x (Asymptotic convergence)? Fully causal/sequential: Computation of x(t) requires only data (at t) + Nonlinear

44 Methods Control Theoretic Methods: Kalman filter Restrictive Assumptions on noise + Fully causal/sequential

45 Methods Local Regularization [Lamm, Scofield 01; Lamm 03] x α (t) is given by an ODE related to Volterra equation + Fully causal/sequential + Convergence theory + Nonlinear Quite specific method for Volterra equations

46 Methods Kügler online parameter identification [Kügler 08] x (t) = G(x(t)) (F (x(t)) y(t)) + Fully causal/sequential + Asymptotic convergence theory (also for nonlinear case) Assumptions realistic? Assumes x does not depend on time

47 The wanted method fully causal/sequential method convergence theory in the illposed and nonlinear case no/weak assumptions on operator no/weak assumptions on solution no assumption on noise efficient to compute

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