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Christian Kahle

Publications and source records attributed to Christian Kahle.

At least 19 recordsLinked to original sources

Combining diffuse and sharp interface methods in shape optimisation

We develop a concept for the numerical treatment of shape optimization problems based on the combination of phase field and sharp interface methods. On the one hand, phase field methods are very well suited to numerically determine the shape, size and topology of a sought domain, but on the other hand they have problems to sharpen out domains where they e.g. should develop corners. However, this is the strength of a sharp-interface approach developed in our group, which provides shape updates in the Lipschitz topology. This leads to a two-stage process that first determines an optimized shape using the phase field method. The resulting domain is the starting solution for the sharp interface shape optimization method. Both methods are discretized with the finite element method. The starting mesh for the sharp method is constructed from the finite element mesh of the optimal phase field solution using its properly post processed zero-level set. We describe this construction process in detail and investigate the performance of our method on a selection of test problems from the literature and from applications.

math.OC

A reduced basis method for parabolic PDEs based on a space-time least squares formulation

In this work, we present a POD-greedy reduced basis method for parabolic partial differential equations (PDEs), based on the least squares space-time formulation proposed in [Hinze, Kahle, Stahl, A least-squares space-time approach for parabolic equations, 2023, arXiv:2305.03402] that assumes only minimal regularity. We extend this approach to the parameter-dependent case. The corresponding variational formulation then is based on a parameter-dependent, symmetric, uniformly coercive, and continuous bilinear form. We apply the reduced basis method to this formulation, following the well-developed techniques for parameterized coercive problems, as seen e.g. in reduced basis methods for parameterized elliptic PDEs. We present an offline-online decomposition and provide certification with absolute and relative error bounds. The performance of the method is demonstrated using selected numerical examples.

math.NA

Long-time behavior of solutions to a fluid dynamic shape optimization problem via phase-field method

We investigate the long time behavior of solutions to a shape and topology optimization problem with respect to the time-dependent Navier--Stokes equations. The sought topology is represented by a stationary phase-field that represents a smooth indicator function. The fluid equations are approximated by a porous media approach and are time-dependent. In the latter aspect, the considered problem formulation extends earlier work. We prove that if the time horizon tends to infinity, minima of the time-dependent problem converge towards minima of the corresponding stationary problem. To do so, a convergence rate with respect to the time horizon, of the values of the objective functional, is analytically derived. This allowed us to prove that the solution to the time-dependent problem converges to a phase-field, as the time horizon goes to infinity, which is proven to be a minimizer for the stationary problem. We validate our results by numerical investigation.

math.OC

Sharp-interface limit of a multi-phase spectral shape optimization problem for elastic structures

We consider an optimization problem for the eigenvalues of a multi-material elastic structure that was previously introduced by Garcke et al. [Adv. Nonlinear Anal. 11 (2022), no. 1, 159--197]. There, the elastic structure is represented by a vector-valued phase-field variable, and a corresponding optimality system consisting of a state equation and a gradient inequality was derived. In the present paper, we pass to the sharp-interface limit in this optimality system by the technique of formally matched asymptotics. Therefore, we derive suitable Lagrange multipliers to formulate the gradient inequality as a pointwise equality. Afterwards, we introduce inner and outer expansions, relate them by suitable matching conditions and formally pass to the sharp-interface limit by comparing the leading order terms in the state equation and in the gradient equality. Furthermore, the relation between these formally derived first-order conditions and results of Allaire and Jouve [Comput. Methods Appl. Mech. Engrg., 194 (2005), pp. 3269--3290] obtained in the framework of classical shape calculus is discussed. Eventually, we provide numerical simulations for a variety of examples. In particular, we illustrate the sharp-interface limit and also consider a joint optimization problem of simultaneous compliance and eigenvalue optimization.

math.OC

A least-squares space-time approach for parabolic equations

We propose a least squares formulation for abstract parabolic equations in the natural $L^2(0,T;V^\star)\times H$ norm which only relies on natural regularity assumptions on the data of the problem. The resulting bilinear form then is symmetric, coercive and continuous. We provide two space-time Galerkin frameworks for the numerical approximation. The first one uses a conformal discretization of the underlying bilinear system and relies on the fact that the $V^*-$norm of basis functions can be evaluated exactly. The second approach is nonconforming an replaces the evaluation of the $V^*-$norm by a discrete pendant. We prove convergence for both approaches and illustrate our analytical findings by selected numerical experiments.

math.NA

Phase-Field Methods for Spectral Shape and Topology Optimization

We optimize a selection of eigenvalues of the Laplace operator with Dirichlet or Neumann boundary conditions by adjusting the shape of the domain on which the eigenvalue problem is considered. Here, a phase-field function is used to represent the shapes over which we minimize. The idea behind this method is to modify the Laplace operator by introducing phase-field dependent coefficients in order to extend the eigenvalue problem on a fixed design domain containing all admissible shapes. The resulting shape and topology optimization problem can then be formulated as an optimal control problem with PDE constraints in which the phase-field function acts as the control. For this optimal control problem, we establish first-order necessary optimality conditions and we rigorously derive its sharp interface limit. Eventually, we present and discuss several numerical simulations for our optimization problem.

math.OC

Optimal Control of Droplets on a Solid Surface using Distributed Contact Angles

Controlling the shape and position of moving and pinned droplets on a solid surface is an important feature often found in microfluidic applications. However, automating them, e.g., for high-throughput applications, does rarely involve model-based optimal control strategies. In this work, we demonstrate the optimal control of both the shape and position of a droplet sliding on an inclined surface. This basic test case is a fundamental building block in plenty of microfluidic designs. The static contact angle between the solid surface, the surrounding gas, and the liquid droplet serves as the control variable. By using several control patches, e.g., like done in electrowetting, the contact angles are allowed to vary in space and time. In computer experiments, we are able to calculate mathematically optimal contact angle distributions using gradient-based optimization. The dynamics of the droplet are described by the Cahn-Hilliard-Navier-Stokes equations. We anticipate our demonstration to be the starting point for more sophisticated optimal design and control concepts.

physics.flu-dyn

Optimal Control of Sliding Droplets using the Contact Angle Distribution

Controlling the shape and position of moving and pinned droplets on a solid surface is an important feature often found in microfluidic applications. In this work, we consider a well investigated phase field model including contact line dynamics as the state system for an (open-loop) optimal control problem. Here the spatially and temporally changeable contact angles between droplet and solid are considered as the control variables. We consider a suitable, energy stable, time discrete version of the state equation in our optimal control problem. We discuss regularity of the solution to the time discrete state equation and its continuity and differentiability properties. Furthermore, we show existence of solutions and state first order optimality conditions to the optimal control problem. We illustrate our results by actively pushing a droplet uphill against gravity in an optimal way.

math.NA

Comparison of Energy Stable Simulation of Moving Contact Line Problems using a Thermodynamically Consistent Cahn-Hilliard Navier-Stokes Model

Liquid droplets sliding along solid surfaces are a frequently observed phenomenon in nature, e.g., raindrops on a leaf, and in everyday situations, e.g., drops of water in a drinking glass. To model this situation, we use a phase field approach. The bulk model is given by the thermodynamically consistent Cahn-Hilliard Navier-Stokes model from [Abels et al., Math. Mod. Meth. Appl. Sc., 22(3), 2012]. To model the contact line dynamics we apply the generalized Navier boundary condition for the fluid and the dynamically advected boundary contact angle condition for the phase field as derived in [Qian et al., J. Fluid Mech., 564, 2006]. In recent years several schemes were proposed to solve this model numerically. While they widely differ in terms of complexity, they all fulfill certain basic properties when it comes to thermodynamic consistency. However, an accurate comparison of the influence of the schemes on the moving contact line is rarely found. Therefore, we thoughtfully compare the quality of the numerical results obtained with three different schemes and two different bulk energy potentials. Especially, we discuss the influence of the different schemes on the apparent contact angles of a sliding droplet.

physics.comp-ph

A phase field approach to shape optimization in Navier--Stokes flow with integral state constraint

We consider the shape optimization of an object in Navier--Stokes flow by employing a combined phase field and porous medium approach, along with additional perimeter regularization. By considering integral control and state constraints, we extend the results of earlier works concerning the existence of optimal shapes and the derivation of first order optimality conditions. The control variable is a phase field function that prescribes the shape and topology of the object, while the state variables are the velocity and the pressure of the fluid. In our analysis, we cover a multitude of constraints which include constraints on the center of mass, the volume of the fluid region, and the drag of the object. Finally, we present numerical results of the optimization problem that is solved using the variable metric projection type (VMPT) method proposed by Blank and Rupprecht, where we consider one example of topology optimization without constraints and one example of maximizing the lift of the object with a state constraint, as well as a comparison with earlier results for the drag minimization.

math.OC

Finite element error estimates in $L^2$ for regularized discrete approximations to the obstacle problem

This work is concerned with quasi-optimal a-priori finite element error estimates for the obstacle problem in the $L^2$-norm. The discrete approximations are introduced as solutions to a finite element discretization of an accordingly regularized problem. The underlying domain is only assumed to be convex and polygonally or polyhedrally bounded such that an application of point-wise error estimates results in a rate less than two in general. The main ingredient for proving the quasi-optimal estimates is the structural and commonly used assumption that the obstacle is inactive on the boundary of the domain. Then localization techniques are used to estimate the global $L^2$-error by a local error in the inner part of the domain, where higher regularity for the solution can be assumed, and a global error for the Ritz-projection of the solution, which can be estimated by standard techniques. We validate our results by numerical examples.

math.NA

A FEM for an optimal control problem subject to the fractional Laplace equation

We study the numerical approximation of linear-quadratic optimal control problems subject to the fractional Laplace equation with its spectral definition. We compute an approximation of the state equation using a discretization of the Balakrishnan formula that is based on a finite element discretization in space and a sinc quadrature approximation of the additionally involved integral. A tailored approach for the numerical solution of the resulting linear systems is proposed. Concerning the discretization of the optimal control problem we consider two schemes. The first one is the variational approach, where the control set is not discretized, and the second one is the fully discrete scheme where the control is discretized by piecewise constant functions. We derive finite element error estimates for both methods and illustrate our results by numerical experiments.

math.NA

Bayesian parameter identification in Cahn-Hilliard models for biological growth

We consider the inverse problem of parameter estimation in a diffuse interface model for tumour growth. The model consists of a fourth-order Cahn-Hilliard system and contains three phenomenological parameters: the tumour proliferation rate, the nutrient consumption rate, and the chemotactic sensitivity. We study the inverse problem within the Bayesian framework and construct the likelihood and noise for two typical observation settings. One setting involves an infinite-dimensional data space where we observe the full tumour. In the second setting we observe only the tumour volume, hence the data space is finite-dimensional. We show the well-posedness of the posterior measure for both settings, building upon and improving the analytical results in [C. Kahle and K.F. Lam, Appl. Math. Optim. (2018)]. A numerical example involving synthetic data is presented in which the posterior measure is numerically approximated by the sequential Monte Carlo approach with tempering.

math.NA

Parameter identification via optimal control for a Cahn--Hilliard-chemotaxis system with a variable mobility

We consider the inverse problem of identifying parameters in a variant of the diffuse interface model for tumour growth model proposed by Garcke, Lam, Sitka and Styles (Math. Models Methods Appl. Sci. 2016). The model contains three constant parameters; namely the tumour growth rate, the chemotaxis parameter and the nutrient consumption rate. We study the inverse problem from the viewpoint of PDE-constrained optimal control theory and establish first order optimality conditions. A chief difficulty in the theoretical analysis lies in proving high order continuous dependence of the strong solutions on the parameters, in order to show the solution map is continuously Fréchet differentiable when the model has a variable mobility. Due to technical restrictions, our results hold only in two dimensions for sufficiently smooth domains. Analogous results for polygonal domains are also shown for the case of constant mobilities. Finally, we propose a discrete scheme for the numerical simulation of the tumour model and solve the inverse problem using a trust-region Gauss--Newton approach.

math.OC

Optimal Control of time-discrete two-phase flow driven by a diffuse-interface model

We propose a general control framework for two-phase flows with variable densities in the diffuse interface formulation, where the distribution of the fluid components is described by a phase field. The flow is governed by the diffuse interface model proposed in [Abels, Garcke, Grün, M3AS 22(3):1150013(40), 2012]. On the basis of the stable time discretization proposed in [Garcke, Hinze, Kahle, APPL NUMER MATH, 99:151--171, 2016] we derive necessary optimality conditions for the time-discrete and the fully discrete optimal control problem. We present numerical examples with distributed and boundary controls, and also consider the case, where the initial value of the phase field serves as control variable.

math.OC

Preconditioning of a coupled Cahn--Hilliard Navier--Stokes system

Recently, Garcke et al.[Garcke, Hinze, Kahle, A stable and linear time discretization for a thermodynamically consistent model for two-phase incompressible flow, Applied Numerical Mathematics 99, pp. 151-171, 2016] developed a consistent discretization scheme for a thermodynamically consistent diffuse interface model for incompressible two-phase flows with different densities. At the heart of this method lies the solution of large and sparse linear systems that arise in a semismooth Newton method. We propose the use of preconditioned Krylov subspace solvers using effective Schur complement approximations. Numerical results illustrate the efficiency of our approach. In particular, our preconditioner is shown to be robust with respect to parameter changes.

math.NA

Diffuse interface approaches in atmosphere and ocean - modeling and numerical implementation

We propose to model physical effects at the sharp density interface between atmosphere and ocean with the help of diffuse interface approaches for multiphase flows with variable densities. We use the variable-density model proposed in \cite{m6:AbelsGarckeGruen_CHNSmodell}. This results in a Cahn-Hilliard/Navier-Stokes type system which we complement with tangential Dirichlet boundary conditions to incorporate the effect of wind in the atmosphere. Wind is responsible for waves at the surface of the ocean, whose dynamics have an important impact on the $CO_2-$exchange between ocean and atmosphere. We tackle this mathematical model numerically with fully adaptive and integrated numerical schemes tailored to the simulation of variable density multiphase flows governed by diffuse interface models. Here, {\it fully adaptive, integrated, efficient, and reliable} means that the mesh resolution is chosen by the numerical algorithm according to a prescribed error tolerance in the {\it a posteriori} error control on the basis of residual-based error indicators, which allow to estimate the true error from below (efficient) and from above (reliable). Our approach is based on the work of \cite{m6:HintermuellerHinzeKahle_adaptiveCHNS,m6:GarckeHinzeKahle_CHNS_AGG_linearStableTimeDisc}, where a fully adaptive efficient and reliable numerical method for the simulation of two-dimensional multiphase flows with variable densities is developed. We incorporate the stimulation of surface waves via appropriate boundary conditions.

math.NA

A $L^\infty$ bound for the Cahn--Hilliard equation with relaxed non-smooth free energy

Phase field models are widely used to describe multiphase systems. Here a smooth indicator function, called phase field, is used to describe the spatial distribution of the phases under investigation. Material properties like density or viscosity are introduced as given functions of the phase field. These parameters typically have physical bounds to fulfil, e.g. positivity of the density. To guarantee these properties, uniform bounds on the phase field are of interest. In this work we derive a uniform bound on the solution of the Cahn--Hilliard system, where we use the double-obstacle free energy, that is relaxed by Moreau--Yosida relaxation.

math.NA