Dans des milieux tels que les gaz, les plasmas et les milieux granulaires, un objet se déplaçant à des vitessessupersoniques, compresse et chauffe le fluide devant lui, formant ainsi une onde de choc. La zone hors-équilibreappelée front d’onde, où ont lieu de brusques variations de température, pression et densité, présente unestructure particulière, avec notamment des distributions des vitesses des particules fortement non-gaussienneset difficiles à visualiser. Dans une avancée importante en 1951, Mott-Smith décrit le front d’onde comme lasuperposition des deux états que sont le gaz supersonique initial et le gaz subsonique compressé et chauffé,impliquant ainsi l’existence de distributions des vitesses bimodales. Des expériences à grands nombres de Machont confirmé cette structure globalement bimodale. Ce modèle n’explique cependant pas la présence d’un surplusde particules à des vitesses intermédiaires, entre le gaz supersonique et le gaz subsonique.Ce travail de thèse porte sur l’étude des ondes de choc dans les gaz granulaires, où les particules interagissentuniquement par des collisions binaires inélastiques. Dans ces gaz dissipatifs, la température granulaire, traduisantl’agitation des particules, permet de définir l’équivalent d’une vitesse du son par analogie aux gaz moléculaires.Les basses valeurs de ces vitesses du son dans les gaz granulaires, permettent de générer facilement des ondes dechoc dans lesquelles chaque particule peut être suivie, contrairement aux gaz moléculaires. La première partie decette étude porte sur l’effet de la dissipation d’énergie, due aux collisions inélastiques, sur la structure des ondesde choc dans les gaz granulaires. Les modifications induites sur la température, la densité et la vitesse moyennemesurées, sont interprétées à l’aide d’un modèle basé sur l’hypothèse bimodale de Mott-Smith et intégrant ladissipation d’énergie. La deuxième partie est consacrée à l’interprétation des distributions des vitesses dans lefront d’onde. À partir des expériences réalisées dans les gaz granulaires, une description trimodale, incluant unétat intermédiaire supplémentaire, est proposée et étendue avec succès aux distributions des vitesses dans lesgaz moléculaires. / In different materials such as gases, plasmas and granular material, an object, moving at supersonic speed,compresses and heats the fluid ahead. The shock front is the out-of-equilibrium area, where violent changesin temperature, pressure and density occur. It has a particular structure with notably strongly non-Gaussianparticle velocity distributions, which are difficult to observe. In an important breakthrough in 1951, Mott-Smithdescribes the shock front as a superposition of two states: the initial supersonic gas and the compressed andheated subsonic gas, implying existence of bimodal velocity distributions. Several experiences at high Machnumbers show this overall bimodal structure. However this model does not explain the existence of a surplusof particles with intermediate velocities, between the supersonic and the subsonic gas.This thesis focuses on shock waves in granular gases, where particles undergo only inelastic binary collisions.In these dissipative gases, the granular temperature, reflecting the particle random motion, allows to definethe equivalent to the speed of sound by analogy with molecular gases. The low values of this speed of soundpermit to generate easily shock waves in which each particle can be tracked, unlike molecular gases. The firstpart of this work focuses on the effect of the energy dissipation, due to inelastic collisions, on the shock frontstructure in granular gases. Modifications induced on temperature, density and mean velocity, are captured bya model based on the bimodal hypothesis of Mott-Smith and including energy dissipation. The second part isdevoted to the study of velocity distributions in the shock front. From experiences in granular gases, a trimodaldescription, including an additional intermediate state, is proposed and successfully extended to the velocitydistributions in molecular gases.

Un nouveau mod`ele r´eduit pour le transport de faisceaux d’´electrons relativistes dans des solide ou des plasma denses est propos´e. Il est bas´e sur la r´esolution des deux premiers moments angulaires de l’´equation cin´etique relativiste, compl´et´es par une relation de fermeture d´eduite du principe de maximisation de l’entropie angulaire de Minerbo. Le mod`ele prend en compte aussi bien les effets collectifs du transport avec les champs ´electromagn´etiques auto g´en´er´es que les effets collisionnels li´es au ralentissement des ´electrons par collision sur les plasmons, les ´electrons li´es et les ´electrons libres du milieu ainsi que leur diffusion angulaire par collisions sur les ´electrons et les ions. Le mod`ele permet une r´esolution num´erique rapide des ´equations du transport de faisceau d’´electrons rapides tout en d´ecrivant l’´evolution cin´etique de leur fonction de distribution. Malgr´e le fait de travailler avec les grandeurs angulaires moyennes, le mod`ele a ´et´e valid´e par comparaison avec des solutions analytiques d´eriv´ees dans un cas acad´emique de transport de faisceau mono ´energ´etique et collimat´e dans un plasma dense et chaud d’Hydrog`ene ainsi qu’avec une simulation PIC hybride dans un cas r´ealiste de transport d’´electrons acc´el´er´es par laser dans une cible solide. Le mod`ele est appliqu´e `a l’´etude de l’´emission de photons Kα lors d’exp´eriences laser-plasma ainsi qu’a` la g´en´eration d’ondes de choc. / A new hybrid reduced model for relativistic electron beam transport in solids and dense plasmas is presented. It is based on the two first angular moments of the relativistic kinetic equation completed with the Minerbo maximum angular entropy closure. It takes into account collective effects with the self-generated electromagnetic fields as well as collisional effects with the slowing down of the elec- trons in collisions with plasmons, bound and free electrons and their angular scattering on both ions and electrons. This model allows for fast computations of relativistic electron beam transport while describing the kinetic distribution function evolution. Despite the loss of information concerning the angular distribution of the electron beam, the model reproduces analytical estimates in the academic case of a collimated and monoenergetic electron beam propagating through a warm and dense Hydro- gen plasma and hybrid PIC simulation results in a realistic laser-generated electron beam transport in a solid target. The model is applied to the study of the emission of Kα photons in laser-solid experiments and to the generation of shock waves.

Made available in DSpace on 2014-06-11T19:26:18Z (GMT). No. of bitstreams: 0 Previous issue date: 2009-01-12Bitstream added on 2014-06-13T20:54:32Z : No. of bitstreams: 1 souza_mp_me_bauru.pdf: 1121017 bytes, checksum: 8ed8fe65e5cd46111ec16064bc42b009 (MD5) / Coordenação de Aperfeiçoamento de Pessoal de Nível Superior (CAPES) / No presente trabalho desenvolve-se um estudo de modelagem matemática e simulação numérica do escoamento bifásico gás-sólido em leito fluidizado borbulhante. Utiliza-se o modelo Euleriano de duas fases separadas formulando o tensor das tensões da fase sólida através da teoria cinética dos escoamentos granulares. As simulações numéricas são realizadas através do código fonte MFIX (Multiphase Flow with Interphase eXchanges) desenvolvido no NETL (National Energy Technology Laboratory). Os resultados de simulação numérica são avaliados por meio da análise da influência dos seguintes parâmetros: malha computacional e esquemas de discretização dos termos convectivos das equações de conservação. Com base nos estudos teóricos e resultados obtidos durante o trabalho conclui-se que esquemas de primeira, tais como FOUP são altamente difusivos, já os resultados obtidos utilizando o esquema de alta ordem, Superbee, produziu resultados de melhor qualidade para as malhas testadas neste trabalho. Além disso, os resultados mostraram-se bastante dependentes do tamanho da malha computacional. / In the present work is described a mathematical model and numerical simulation of gas-solid two-phase flow in a bubbling fluidized bed. It is used the Eulerian gas-solid two-fluid model and the solid phase stress tensor is modeled considering the kinetic theory of granular flows. The numerical simulations were developed using the MFIX (Multiphase Flow with Interphase eXchanges) code developed in NETL (National Energy Technology Laboratory). The numerical diffusion is analyzed considering a single bubbling detachment and its movement process in a two-dimensional bubbling fluidized bed using the bubble shape as a metric for results description. The influence of computacional grid it is also analyzed. It is concluded that SuperBee scheme produces the better results and analysis about estimating uncertainty in grid refinement should be studied.

A presente pesquisa tem como objetivo realizar um estudo teórico e desenvolver simulações computacionais envolvendo a dinâmica de sistemas gás-sólido. O foco principal do trabalho é a modelagem do particulado através da análise das forças de contato entre partículas de materiais granulares utilizando modelos contínuos baseados na mecânica dos solos e na teoria cinética dos escoamentos granulares (sistemas grandes com muitas partículas, formulação Euleriana - Volumes Finitos) e modelos discretos baseados nas características físicas dos materiais (sistemas intermediários e número limitado de partículas, formulação Lagrangeana - Método dos Elementos Discretos). Investigam-se os modelos existentes na literatura com intuito de melhorar os modelos contínuos e discretos baseados na interação entre as partículas que caracterizam a dinâmica do particulado em sistemas gás-sólido. Propõe-se uma nova abordagem para a determinação do coeficiente de rigidez da mola baseada em uma equivalência entre os modelos lineares e não-lineares. Utiliza-se o código fonte MFIX para realizar simulações computacionais da dinâmica de sistemas gás-sólido, analisando o processo de fluidização, mistura e segregação de partículas, influência das correlações de arrasto, e análise das forças de contato entre as partículas através do novo método para a determinação do coeficiente de rigidez da mola . Os resultados obtidos são comparados com dados numéricos e experimentais da literatura. / The purpose of the present study is to perform a theoretical study and develop numerical simulations involving dynamic in gas-solid systems. The focus of the work is the modeling of particulate matter using continuous models based on soil mechanics and the kinetic theory of granular flows (large systems with many particles, Eulerian formulation - Finite Volume) and discrete models based on physical characteristics of the particles (intermediate systems and limited number of particles, Lagrangian formulation - Discrete Element Method). It is proposed a new approach to determine the normal spring stiffness coefficient of the linear model through the numerical solution for the overlap between particles in non-linear models. The linear spring stiffness is determined using an equivalence between the linear and the non-linear models. It is used the MFIX computational code to perform numerical simulations of the dynamics of gas-solid systems. It is analyzed the processes of fluidization, mixing and particle segregation and the influence of drag correlations. The proposed approach for normal spring stiffness coefficient is applied in the numerical simulations of two problems: single freely falling particle and bubbling fluidized bed. The results were compared with numerical and experimental data from literature.

Turbulence is an open and challenging problem for mathematical approaches, physical modeling and numerical simulations. Numerical solutions contribute significantly to the understand of the nature and effects of turbulence. The focus of this thesis is the development of appropriate numerical methods for the computer simulation of turbulent flows. Many of the existing approaches to turbulence utilize analogies from kinetic theory. Degond & Lemou (J. Math. Fluid Mech., 4, 257-284, 2002) derived a k-✏ type turbulence model completely from kinetic theoretic framework. In the first part of this thesis, a numerical method is developed for the computer simulation based on this model. The Boltzmann equation used in the model has an isotropic, relaxation collision operator. The relaxation time in the collision operator depends on the microscopic turbulent energy, making it difficult to construct an efficient numerical scheme. In order to achieve the desired numerical efficiency, an appropriate change of frame is applied. This introduces a stiff relaxation source term in the equations and the concept of asymptotic preserving schemes is then applied to tackle the stiffness. Some simple numerical tests are introduced to validate the new scheme. In the second part of this thesis, alternative approaches are sought for more efficient numerical techniques. The Lattice Boltzmann Relaxation Scheme (LBRS) is a novel method developed recently by Rohan Deshmukh and S.V. Raghuram Rao for simulating compressible flows. Two different approaches for the construction of implicit sub grid scale -like models as Implicit Large Eddy Simulation (ILES) methods, based on LBRS, are proposed and are tested for Burgers turbulence, or Burgulence. The test cases are solved over a largely varying Reynolds number, demonstrating the efficiency of this new ILES-LBRS approach. In the third part of the thesis, as an approach towards the extension of ILES-LBRS to incompressible flows, an artificial compressibility model of LBRS is proposed. The modified framework, LBRS-ACM is then tested for standard viscous incompressible flow test cases.

Lattice Boltzmann Method has been quite successful for incompressible flows. Its extension for compressible (especially supersonic and hypersonic) flows has attracted lot of attention in recent time. There have been some successful attempts but nearly all of them have either resulted in complex or expensive equilibrium function distributions or in extra energy levels. Thus, an efficient Lattice Boltzmann Method for compressible fluid flows is still a research idea worth pursuing for. In this thesis, a new Lattice Boltzmann Method has been developed for compressible flows, by using the concept of a relaxation system, which is traditionally used as semilinear alternative for non-linear hypebolic systems in CFD. In the relaxation system originally introduced by Jin and Xin (1995), the non-linear flux in a hyperbolic conservation law is replaced by a new variable, together with a relaxation equation for this new variable augmented by a relaxation term in which it relaxes to the original nonlinear flux, in the limit of a vanishing relaxation parameter. The advantage is that instead of one non-linear hyperbolic equation, two linear hyperbolic equations need to be solved, together with a non-linear relaxation term. Based on the interpretation of Natalini (1998) of a relaxation system as a discrete velocity Boltzmann equation, with a new isotropic relaxation system as the basic building block, a Lattice Boltzmann Method is introduced for solving the equations of inviscid compressible flows. Since the associated equilibrium distribution functions of the relaxation system are not based on a low Mach number expansion, this method is not restricted to the incompressible limit. Free slip boundary condition is introduced with this new relaxation system based Lattice Boltzmann method framework. The same scheme is then extended for curved boundaries using the ghost cell method. This new Lattice Boltzmann Relaxation Scheme is successfully tested on various bench-mark test cases for solving the equations of compressible flows such as shock tube problem in 1-D and in 2-D the test cases involving supersonic flow over a forward-facing step, supersonic oblique shock reflection from a flat plate, supersonic and hypersonic flows past half-cylinder.

Abstract: The thesis work is part of a project that aims to develop a reliable CFD model to investigate the fluid-dynamics of a fluidized bubbling bed during gasification of refuse derived fuel (RDF) from sorted municipal solid waste (MSW). Gasification is a thermochemical process that converts carbon-containing materials into syngas. In this specific context scaling up is challenging because it implies dealing with a complex chemistry combined to heat and mass transfer phenomena in a multi-phase fluid environment. CFD modeling could represent a potential tool to predict the impact of the reactor configuration and operating conditions on gas yield, composition and potential contaminants. Validation of CFD simulations for such systems has been so far possible using different sophisticated experimental tools, allowing to link the model with experimental data. However, such high tech equipment may not always be available, especially at industrial scale. Hence, this work focuses on investigating the accuracy and numerical sensitivity of two different CFD models employed in the characterization of dense solid-particle flows in bubbling fluidized beds. The key parameter adopted to describe and quantify the dynamic behavior of this multiphase system is the power spectral density (PSD) distribution of pressure fluctuations. This PSD function was used to assess the accuracy of CFD models using one set of operating condition. The same type of analysis, extended to a wider range of operating conditions, may lead to a robust validation of the numerical models presented in this work. In spite of his measurement simplicity, pressure drop data present a strong connection with the bed fluid-dynamics and its interpretation could help to improve the fluidized bed technologies very fast, pushing CFD models closer to applications. / Résumé : Le but de ce projet est de développer un modèle CFD fiable pour étudier la dynamique des fluides d'un lit fluidisé en régime bullant pendant la gazéification de combustibles solides de récupération (CSR) triés à partir de déchets solides municipaux (DSM). La gazéification est un processus thermochimique qui convertit les matériaux contenant du carbone en gaz de synthèse. La mise à l'échelle est difficile dans ce cas car elle implique une chimie complexe combinée aux phénomènes de transfert de chaleur et de masse dans un environnement fluide multiphasique. La modélisation CFD représente un outil potentiel pour prédire l'impact de la configuration du réacteur et des conditions de fonctionnement sur le rendement, la composition et les contaminants potentiels du gaz. La validation des simulations CFD pour de tels systèmes a été jusqu'à présent possible grâce à l’utilisation de différents outils expérimentaux sophistiqués, permettant de lier le modèle aux données expérimentales. Toutefois, un tel équipement de pointe n’est pas toujours disponible, en particulier à l'échelle industrielle. Par conséquent, ce travail se concentre sur l'étude de la précision et de la sensibilité numérique de deux modèles CFD différents, utilisés dans la caractérisation des flux de particules solides denses dans les lits fluidisés bouillonnants. Le paramètre clé adopté pour décrire et quantifier le comportement dynamique de ce système multiphase est la distribution de la densité spectrale de puissance (DSP) des fluctuations de pression. La fonction DSP a été utilisée pour évaluer la précision des modèles CFD en utilisant un ensemble de conditions de fonctionnement. Le même type d'analyse, étendu à une plus large gamme de conditions de fonctionnement, peut conduire à une validation robuste des modèles numériques présentés dans ce travail. En dépit de sa simplicité de mesure, les données de chute de pression présentent une importante corrélation avec les lits fluidisés, de plus, leur interprétation pourrait aider à améliorer ces technologies très rapidement, poussant les modèles CFD plus près des applications.

No description available.

Discovery of ferroelectric (FE) behavior in HfO 2 removed the compatibility roadblocks between the state-of-the-art CMOS and FE memories. Even though FE FETs (FeFETs) are scaled into 22 nm nodes and beyond, the limits of the technology as well as the physical mechanisms and reliability are still under research. In this paper we successfully developed a multiscale modeling platform to understand the interplay between the FE switching and charge trapping. Starting from the nucleation theory and rigorous charge transport modeling we present for the first time a self-consistent modeling framework we used for investigation of reliability and variability in FeFETs.

<p>We construct two independent hierarchies of&nbsp;moment equations and we apply the maximum&nbsp;entropy principle for polyatomic gases. We&nbsp;formulate multivelocity and multitemperature&nbsp;model of Eulerian polyatomic gases starting from&nbsp;kinetic theory, that is compared in the&nbsp;neighborhood of global equilibrium state to the&nbsp;models based on extended thermodynamics. We&nbsp;analyze diffusion asymptotics of the Boltzmann&nbsp;<br />equations for mixtures of monatomic gases.</p> / <p>Конструишу се две независне хијерархије<br />једначина момената и примењује се принцип<br />максимума ентропије за вишеатомске гасове.<br />Формира се вишебрзински и вишетемпературни<br />модел Ојлерових вишеатомских гасова полазећи<br />од кинетичке теорије и добијени модел се<br />пореди у околини стања глобалне равнотеже са<br />моделом проширене термодинамике. Анализира<br />се дифузиона асимптотика Болцманових<br />једначина за мешавине једноатомских гасова.</p> / <p>Konstruišu se dve nezavisne hijerarhije<br />jednačina momenata i primenjuje se princip<br />maksimuma entropije za višeatomske gasove.<br />Formira se višebrzinski i višetemperaturni<br />model Ojlerovih višeatomskih gasova polazeći<br />od kinetičke teorije i dobijeni model se<br />poredi u okolini stanja globalne ravnoteže sa<br />modelom proširene termodinamike. Analizira<br />se difuziona asimptotika Bolcmanovih<br />jednačina za mešavine jednoatomskih gasova.</p>