In this research, the homogenization relations for elastic properties in isotropic and anisotropic materials are studied by applying two-point statistical functions to composite and polycrystalline materials. The validity of the results is investigated by direct comparison with experimental results. In todays technology, where advanced processing methods can provide materials with a variety of morphologies and features in different scales, a methodology to link property to microstructure is necessary to develop a framework for material design. Statistical distribution functions are commonly used for the representation of microstructures and also for homogenization of materials properties. The use of two-point statistics allows the materials designer to consider morphology and distribution in addition to properties of individual phases and components in the design space. This work is focused on studying the effect of anisotropy on the homogenization technique based on two-point statistics. The contribution of one-point and two-point statistics in the calculation of elastic properties of isotropic and anisotropic composites and textured polycrystalline materials will be investigated. For this purpose, an isotropic and anisotropic composite is simulated and an empirical form of the two-point probability functions are used which allows the construction of a composite Hull. The homogenization technique is also applied to two samples of Al-SiC composite that were fabricated through extrusion with two different particle size ratios (PSR). To validate the applied methodology, the elastic properties of the composites are measured by Ultrasonic methods. This methodology is then extended to completely random and textured polycrystalline materials with hexagonal crystal symmetry and the effect of cold rolling on the annealing texture of near- Titanium alloy are presented.

Mathematical theory of homogenization of partial differential equations is relatively a new area of research (30-40 years or so) though the physical and engineering applications were well known. It has tremendous applications in various branches of engineering and science like : material science ,porous media, study of vibrations of thin structures, composite materials to name a few. There are at present various methods to study homogenization problems (basically asymptotic analysis) and there is a vast amount of literature in various directions. Homogenization arise in problems with oscillatory coefficients, domain with large number of perforations, domain with rough boundary and so on. The latter one has applications in fluid flow which is categorized as oscillating boundaries. In fact ,in this thesis, we consider domains with oscillating boundaries. We plan to study to homogenization of certain optimal control problems with oscillating boundaries. This thesis contains 6 chapters including an introductory Chapter 1 and future proposal Chapter 6. Our main contribution contained in chapters 2-5. The oscillatory domain under consideration is a 3-dimensional cuboid (for simplicity) with a large number of pillars of length O(1) attached on one side, but with a small cross sectional area of order ε2 .As ε0, this gives a geometrical domain with oscillating boundary. We also consider 2-dimensional oscillatory domain which is a cross section of the above 3-dimensional domain. In chapters 2 and 3, we consider the optimal control problem described by the Δ operator with two types of cost functionals, namely L2-cost functional and Dirichlet cost functional. We consider both distributed and boundary controls. The limit analysis was carried by considering the associated optimality system in which the adjoint states are introduced. But the main contribution in all the different cases(L2 and Dirichlet cost functionals, distributed and boundary controls) is the derivation of error estimates what is known as correctors in homogenization literature. Though there is a basic test function, one need to introduce different test functions to obtain correctors. Introducing correctors in homogenization is an important aspect of study which is indeed useful in the analysis, but important in numerical study as well. The setup is the same in Chapter 4 as well. But here we consider Stokes’ Problem and study asymptotic analysis as well as corrector results. We obtain corrector results for velocity and pressure terms and also for its adjoint velocity and adjoint pressure. In Chapter 5, we consider a time dependent Kirchhoff-Love equation with the same domain with oscillating boundaries with a distributed control. The state equation is a fourth order hyperbolic type equation with associated L2-cost functional. We do not have corrector results in this chapter, but the limit cost functional is different and new. In the earlier chapters the limit cost functional were of the same type.

Cette thèse contient deux matières différentes. Dans la première partie, deux cas sont considérés. L'un est le modèle plus lisse de la plaque mince et l'autre est les équations des limites elliptiques avec des données limites incertaines. Dans cette partie, les convergences stochastiques des méthodes des éléments finis sont prouvées pour chaque problème.Dans la deuxième partie, nous fournissons une analyse mathématique du problème inverse linéarisé dans la tomographie d'impédance électrique multifréquence. Nous présentons un cadre mathématique et numérique pour une procédure d'imagerie du tenseur de conductivité électrique anisotrope en utilisant une nouvelle technique appelée Tentomètre de diffusion Magnéto-acoustographie et proposons une approche de contrôle optimale pour reconstruire le facteur de propriété intrinsèque reliant le tenseur de diffusion au tenseur de conductivité électrique anisotrope. Nous démontrons la convergence et la stabilité du type Lipschitz de l'algorithme et présente des exemples numériques pour illustrer sa précision. Le modèle cellulaire pour Electropermécanisme est démontré. Nous étudions les paramètres efficaces dans un modèle d'homogénéisation. Nous démontrons numériquement la sensibilité de ces paramètres efficaces aux paramètres microscopiques critiques régissant l'électropermécanisme. / This thesis contains two different subjects. In first part, two cases are considered. One is the thin plate spline smoother model and the other one is the elliptic boundary equations with uncertain boundary data. In this part, stochastic convergences of the finite element methods are proved for each problem.In second part, we provide a mathematical analysis of the linearized inverse problem in multifrequency electrical impedance tomography. We present a mathematical and numerical framework for a procedure of imaging anisotropic electrical conductivity tensor using a novel technique called Diffusion Tensor Magneto-acoustography and propose an optimal control approach for reconstructing the cross-property factor relating the diffusion tensor to the anisotropic electrical conductivity tensor. We prove convergence and Lipschitz type stability of the algorithm and present numerical examples to illustrate its accuracy. The cell model for Electropermeabilization is demonstrated. We study effective parameters in a homogenization model. We demonstrate numerically the sensitivity of these effective parameters to critical microscopic parameters governing electropermeabilization..

<p>The mathematical modelling of the reaction and diffusion mechanism of lipophilic toxic compounds in the mammalian cell is a challenging task because of its considerable complexity and variation in the architecture of the cell. The heterogeneity of the cell regarding the enzyme distribution participating in the bio-transformation, makes the modelling even more difficult. In order to reduce the complexity of the model, and to make it less computationally expensive and numerically treatable, Homogenization techniques have been used. The resulting complex system of Partial Differential Equations (PDEs), generated from the model in 2-dimensional axi-symmetric setting is implemented in Comsol Multiphysics. The numerical results obtained from the model show a nice agreement with the in vitro cell experimental results. The model can be extended to more complex reaction systems and also to 3-dimensional space. For the reduction of complexity and computational cost, we have implemented a model of mixed PDEs and Ordinary Differential Equations (ODEs). We call this model as Non-Standard Compartment Model. Then the model is further reduced to a system of ODEs only, which is a Standard Compartment Model. The numerical results of the PDE Model have been qualitatively verified by using the Compartment Modeling approach. The quantitative analysis of the results of the Compartment Model shows that it cannot fully capture the features of metabolic system considered in general. Hence we need a more sophisticated model using PDEs for our homogenized cell model.</p> / Computational Modelling of the Mammalian Cell and Membrane Protein Enzymology

No description available.

The direct chill (DC) casting technique to produce billets for extrusion and ingots for rollingwas developed in the 1930s. The principle, which is still valid, is a two-stage cooling with a primary cooling at a mould surface followed by water spraying directly on the surface. Improvements of this technique have mainly focused on changes to the primary cooling, where a water-cooled metal mould has been replaced by different techniques to minimize cooling at this stage. The drive for development comes from the extrusion industry, which can increase the productivity and quality of extruded profiles by improving the billet surface appearance and structure. Hot top casting supported by airflow against the casting surface during the primary cooling is currently the standard procedure to achieve acceptable billet surfaces. The goal is to minimize the depth of the surface segregation zone, which is the governing factor for the appearance of different phases in the surface region. Billet surface quality is evaluated by quantifying surface appearance, segregation zone thickness, and  occurrence of large Mg2Si and β-particles near the surface. The β-Al5FeSi intermetallic phase and coarse Mg2Si particles have negative effects on extrudability and workability of 6xxx Al alloys billets. To achieve extruded products with a high surface quality the as-cast billets are  heat-treated before extrusion. During heat treatment the undesired intermetallic particles, i.e., β-AlFeSi platelets are transformed to rounded α-Al(FeMn)Si intermetallic phases. In this  research the formation of the surface segregation for smooth defect-free surfaces in both as-cast and homogenized billets was studied. In addition, the surfaces with defects such as wavy, spot and vertical drag defects were investigated and possible mechanisms for initiation of those defects were explained. Moreover, for a better understanding of the homogenization process in-situ studies of the heat treatment of 6082, 6005, 6060 and 6063 Al alloys were carried out by using a transmission electron microscope (TEM). Based on the observations, an explanation of the probable mechanisms taking place during transformation from β-to α-phase was presented. / <p>Vid tidpunkten för disputationen var följande delarbeten opublicerade: delarbete 5 manuskript, delarbete 6 inskickat och delarbete 7 inskickat.</p><p>At the time of the doctoral defence the following papers were unpublished: paper 5 manuscript, paper 6 submitted, paper 7 submitted.</p>

This thesis is divided into two parts: In the first one (Chapters 1 and 2), we deal with problems arising from quantitative homogenization of the random elliptic operator in divergence form $-\\nabla \\cdot a \\nabla$. In Chapter 1 we study existence and stochastic bounds for the Green function $G$ associated to $-\\nabla \\cdot a \\nabla$ in the case of systems. Without assuming any regularity on the coefficient field $a= a(x)$, we prove that for every (measurable) uniformly elliptic tensor field $a$ and for almost every point $y \\in \\mathbb^d$, there exists a unique Green\'s function centred in $y$ associated to the vectorial operator $-\\nabla \\cdot a\\nabla $ in $\\mathbb{R}^d$, $d> 2$. In addition, we prove that if we introduce a shift-invariant ensemble $\\langle\\cdot \\rangle$ over the set of uniformly elliptic tensor fields, then $\\nabla G$ and its mixed derivatives $\\nabla \\nabla G$ satisfy optimal pointwise $L^1$-bounds in probability. Chapter 2 deals with the homogenization of $-\\nabla \\cdot a \\nabla$ to $-\\nabla \\ah \\nabla$ in the sense that we study the large-scale behaviour of $a$-harmonic functions in exterior domains $\\{ |x| > r \\}$ by comparing them with functions which are $\\ah$-harmonic. More precisely, we make use of the first and second-order correctors to compare an $a$-harmonic function $u$ to the two-scale expansion of suitable $\\ah$-harmonic function $u_h$. We show that there is a direct correspondence between the rate of the sublinear growth of the correctors and the smallness of the relative homogenization error $u- u_h$. The theory of stochastic homogenization of elliptic operators admits an equivalent probabilistic counterpart, which follows from the link between parabolic equations with elliptic operators in divergence form and random walks. This allows to reformulate the problem of homogenization in terms of invariance principle for random walks. The second part of thesis (Chapters 3 and 4) focusses on this interplay between probabilistic and analytic approaches and aims at exploiting it to study invariance principles in the case of degenerate random conductance models and systems of interacting particles. In Chapter 3 we study a random conductance model where we assume that the conductances are independent, stationary and bounded from above but not uniformly away from $0$. We give a simple necessary and sufficient condition for the relaxation of the environment seen by the particle to be diffusive in the sense of every polynomial moment. As a consequence, we derive polynomial moment estimates on the corrector which imply that the discrete elliptic operator homogenises or, equivalently, that the random conductance model satisfies a quenched invariance principle. In Chapter 4 we turn to a more complicated model, namely the symmetric exclusion process. We show a diffusive upper bound on the transition probability of a tagged particle in this process. The proof relies on optimal spectral gap estimates for the dynamics in finite volume, which are of independent interest. We also show off-diagonal estimates of Carne-Varopoulos type.

Understanding the perfusion of blood and drugs in tumours is fundamental to foreseeing the efficacy of treatment regimes and predicting tumour growth. In particular, the dependence of these processes on the tumour vascular structure is poorly established. The objective of this thesis is to derive effective equations describing blood, and drug perfusion in vascular tumours, and specifically to determine the dependence of these on the tumour vascular structure. This dependence occurs through the interaction between two different length scales - that which characterizes the structure of the vascular network, and that which characterizes the tumour as a whole. Our method throughout is to use homogenization as a tool to evaluate this interaction. In Chapter 1 we introduce the problem. In Chapter 2 we develop a theoretical model to describe fluid flow in solid tumours through both the vasculature and the interstitium, at a number of length scales. Ultimately we homogenize over a network of capillaries to form a coupled porous medium model in terms of a vascular density. Whereas in Chapter 2 it is necessary to specify the vascular structure to derive the effective equations, in Chapter 3 we employ asymptotic homogenization through multiple scales to derive the coupled equations for an arbitrary periodic vascular network. In Chapter 4, we extend this analysis to account for advective and diffusive transport of anticancer drugs delivered intravenously; we consider a range of reaction properties in the interstitium and boundary conditions on the vascular wall. The models derived in Chapters 2–4 could be applied to any drug type and treatment regime; to demonstrate their potential, we simulate the delivery of vinblastine in dorsal skinfold chambers in Chapter 5 and make quantitative predictions regarding the optimal treatment regime. In the final Chapter we summarize the main results and indicate directions for further work.

On appelle clinker le matériau obtenu par cuisson de calcaire et d'argile et qui constitue le principal ingrédient du ciment Portland, composant essentiel de la majorité des bétons produits dans le monde. Ce clinker doit être finement broyé avant de pouvoir présenter une réactivité suffisante. La maîtrise des procédés de broyage représente un enjeu considérable pour l'industrie cimentière : il s'agit du premier poste en termes de consommation électrique d'une usine, en partie du fait de l'inefficacité des procédés employés. Les techniques de broyage par compression, apparues au cours des années 80, ont constitué un progrès majeur du point de vue de l'efficacité énergétique, mais la généralisation de leur utilisation a été freinée par des problèmes de maîtrise du procédé, en particulier pour des finesses importantes. L'enjeu de cette thèse est une meilleure compréhension des phénomènes en jeu lors du broyage par compression du clinker, en vue d'un meilleur contrôle des installations industrielles lors de la fabrication de produits fins. Nous nous sommes intéressés en particulier au comportement, du point de vue fondamental, d'un matériau granulaire subissant une fragmentation de ses grains, en nous appuyant sur la simulation numérique d'un Volume Elémentaire Représentatif de matière par les éléments discrets (DEM). Nous avons aussi recherché une loi de comportement permettant de relier contraintes, déformation, et évolution de la taille des particules pour le matériau broyé, en nous appuyant à la fois sur la micromécanique et les techniques d'homogénéisation, et un modèle semi-empirique de bilans de masses. Enfin, un premier pas vers la modélisation du procédé industriel et notamment sa simulation par éléments finis a été esquissé, afin de résorber les difficultés rencontrées en pratique par les industriels / Noindent Clinker is the material obtained by calcination of a mix of clay and limestone, and it is the main component of Portland cement, a crucial ingredient for the majority of concrete used around the world. This clinker must be finely ground to have a sufficient reactivity. Mastering the grinding process is a key issue in the cement industry: it is the first source of expense in terms of electric consumption in a factory, partially because of the overall inefficiency of the process. Compressive grinding techniques, first appeared during the 80's, allow major improvements in terms of energy efficiency, but the general implementation is yet to come, hindered by process control issues, especially for high fineness. The goal of this study is a better understanding of phenomenons occurring during compressive grinding of clinker, in order to provide better process control for industrial installations when dealing with fine products. We particularly choose to study the behaviour, on a fundamental point of view, of a granular material subjected to grain fragmentation, using the numerical simulation of an Elementary Representative Volume of material through Discrete Element Method (DEM). We also looked for a behaviour law able to provide a link between stress, strain, and grain size evolution for the ground material, using at the same time micromechanics and homogenization technique, and a semi-empirical mass balance model. Finally, we made first efforts in the direction of modelling the whole process through numerical simulation by Finite Element Method (FEM), in order to tackle the issue met by the industrials in operations

L’objectif est de construire le modèle homogénéisé d’un écoulement diphasique en milieu poreux et fracturé, en mettant en évidence le phénomène de mélange dynamique (mixing) entre les phases, provoqué par l’hétérogénéité du milieu. L’attention est concentrée sur l’influence de la capillarité. L’homogénéisation à double échelle a été appliquée. Le mixing se manifeste sous forme de la dispersion hydrodynamique et de l’advection renormalisée. Le tenseur de dispersion, déterminé à travers le problème cellulaire, est une fonction non linéaire de la saturation, vitesse d’écoulement, rapport de viscosité et du nombre capillaire. Pour les milieux fracturés, une méthode streamline configurations a été avancée pour le cas diphasique. Elle permet d’obtenir la dispersion et la perméabilité effective sous forme analytique pour des réseaux de fracture périodiques, ou semi-analytique pour des réseaux aléatoires. La simulation d’un déplacement diphasique à la base du nouveau modèle a été réalisée / The objective of the thesis is to develop the homogenized model of a two-phase flow through a porous and fractured medium by highlighting the dynamic mixing between the phases, caused by the medium heterogeneity. Attention is focused on the influence of the capillarity. The two-scale homogenization is applied. The mixing is manifested in form of the hydrodynamic dispersion and renormalized advection. The dispersion tensor, determined by the cell problem, is a nonlinear function of saturation, flow velocity, viscosity ratio and capillary number. For a fractured medium the method of streamline configurations was advanced for a two- phase case. This method enables to obtain the dispersion tensor and the effective permeability in analytical form for periodic fractured networks or in semi-analytical form for random networks. The simulation of two- phase displacement based on the new model is performed