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Computational Simulations and Applications

Computational Simulations and Applications
Author: Jianping Zhu
Publisher: BoD – Books on Demand
Total Pages: 576
Release: 2011-10-26
Genre: Computers
ISBN: 9533074302

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The purpose of this book is to introduce researchers and graduate students to a broad range of applications of computational simulations, with a particular emphasis on those involving computational fluid dynamics (CFD) simulations. The book is divided into three parts: Part I covers some basic research topics and development in numerical algorithms for CFD simulations, including Reynolds stress transport modeling, central difference schemes for convection-diffusion equations, and flow simulations involving simple geometries such as a flat plate or a vertical channel. Part II covers a variety of important applications in which CFD simulations play a crucial role, including combustion process and automobile engine design, fluid heat exchange, airborne contaminant dispersion over buildings and atmospheric flow around a re-entry capsule, gas-solid two phase flow in long pipes, free surface flow around a ship hull, and hydrodynamic analysis of electrochemical cells. Part III covers applications of non-CFD based computational simulations, including atmospheric optical communications, climate system simulations, porous media flow, combustion, solidification, and sound field simulations for optimal acoustic effects.


Understanding Molecular Simulation

Understanding Molecular Simulation
Author: Daan Frenkel
Publisher: Elsevier
Total Pages: 661
Release: 2001-10-19
Genre: Science
ISBN: 0080519989

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Understanding Molecular Simulation: From Algorithms to Applications explains the physics behind the "recipes" of molecular simulation for materials science. Computer simulators are continuously confronted with questions concerning the choice of a particular technique for a given application. A wide variety of tools exist, so the choice of technique requires a good understanding of the basic principles. More importantly, such understanding may greatly improve the efficiency of a simulation program. The implementation of simulation methods is illustrated in pseudocodes and their practical use in the case studies used in the text. Since the first edition only five years ago, the simulation world has changed significantly -- current techniques have matured and new ones have appeared. This new edition deals with these new developments; in particular, there are sections on: Transition path sampling and diffusive barrier crossing to simulaterare events Dissipative particle dynamic as a course-grained simulation technique Novel schemes to compute the long-ranged forces Hamiltonian and non-Hamiltonian dynamics in the context constant-temperature and constant-pressure molecular dynamics simulations Multiple-time step algorithms as an alternative for constraints Defects in solids The pruned-enriched Rosenbluth sampling, recoil-growth, and concerted rotations for complex molecules Parallel tempering for glassy Hamiltonians Examples are included that highlight current applications and the codes of case studies are available on the World Wide Web. Several new examples have been added since the first edition to illustrate recent applications. Questions are included in this new edition. No prior knowledge of computer simulation is assumed.


Computational Multiscale Modeling of Fluids and Solids

Computational Multiscale Modeling of Fluids and Solids
Author: Martin Oliver Steinhauser
Publisher: Springer Science & Business Media
Total Pages: 863
Release: 2008
Genre: Science
ISBN: 3540751165

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The idea of the book is to provide a comprehensive overview of computational physics methods and techniques, that are used for materials modeling on different length and time scales. Each chapter first provides an overview of the physical basic principles which are the basis for the numerical and mathematical modeling on the respective length-scale. The book includes the micro-scale, the meso-scale and the macro-scale. The chapters follow this classification. The book will explain in detail many tricks of the trade of some of the most important methods and techniques that are used to simulate materials on the perspective levels of spatial and temporal resolution. Case studies are occasionally included to further illustrate some methods or theoretical considerations. Example applications for all techniques are provided, some of which are from the author’s own contributions to some of the research areas. Methods are explained, if possible, on the basis of the original publications but also references to standard text books established in the various fields are mentioned.


Computational Simulations and Applications

Computational Simulations and Applications
Author: Jianping Zhu
Publisher: IntechOpen
Total Pages: 574
Release: 2011-10-26
Genre: Computers
ISBN: 9789533074306

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The purpose of this book is to introduce researchers and graduate students to a broad range of applications of computational simulations, with a particular emphasis on those involving computational fluid dynamics (CFD) simulations. The book is divided into three parts: Part I covers some basic research topics and development in numerical algorithms for CFD simulations, including Reynolds stress transport modeling, central difference schemes for convection-diffusion equations, and flow simulations involving simple geometries such as a flat plate or a vertical channel. Part II covers a variety of important applications in which CFD simulations play a crucial role, including combustion process and automobile engine design, fluid heat exchange, airborne contaminant dispersion over buildings and atmospheric flow around a re-entry capsule, gas-solid two phase flow in long pipes, free surface flow around a ship hull, and hydrodynamic analysis of electrochemical cells. Part III covers applications of non-CFD based computational simulations, including atmospheric optical communications, climate system simulations, porous media flow, combustion, solidification, and sound field simulations for optimal acoustic effects.


Simulation in Computational Finance and Economics: Tools and Emerging Applications

Simulation in Computational Finance and Economics: Tools and Emerging Applications
Author: Alexandrova-Kabadjova, Biliana
Publisher: IGI Global
Total Pages: 459
Release: 2012-08-31
Genre: Business & Economics
ISBN: 1466620129

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Simulation has become a tool difficult to substitute in many scientific areas like manufacturing, medicine, telecommunications, games, etc. Finance is one of such areas where simulation is a commonly used tool; for example, we can find Monte Carlo simulation in many financial applications like market risk analysis, portfolio optimization, credit risk related applications, etc. Simulation in Computational Finance and Economics: Tools and Emerging Applications presents a thorough collection of works, covering several rich and highly productive areas of research including Risk Management, Agent-Based Simulation, and Payment Methods and Systems, topics that have found new motivations after the strong recession experienced in the last few years. Despite the fact that simulation is widely accepted as a prominent tool, dealing with a simulation-based project requires specific management abilities of the researchers. Economic researchers will find an excellent reference to introduce them to the computational simulation models. The works presented in this book can be used as an inspiration for economic researchers interested in creating their own computational models in their respective fields.


Multi-Agent Systems

Multi-Agent Systems
Author: Adelinde M. Uhrmacher
Publisher: CRC Press
Total Pages: 582
Release: 2018-10-08
Genre: Computers
ISBN: 142007024X

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Methodological Guidelines for Modeling and Developing MAS-Based Simulations The intersection of agents, modeling, simulation, and application domains has been the subject of active research for over two decades. Although agents and simulation have been used effectively in a variety of application domains, much of the supporting research remains scattered in the literature, too often leaving scientists to develop multi-agent system (MAS) models and simulations from scratch. Multi-Agent Systems: Simulation and Applications provides an overdue review of the wide ranging facets of MAS simulation, including methodological and application-oriented guidelines. This comprehensive resource reviews two decades of research in the intersection of MAS, simulation, and different application domains. It provides scientists and developers with disciplined engineering approaches to modeling and developing MAS-based simulations. After providing an overview of the field’s history and its basic principles, as well as cataloging the various simulation engines for MAS, the book devotes three sections to current and emerging approaches and applications. Simulation for MAS — explains simulation support for agent decision making, the use of simulation for the design of self-organizing systems, the role of software architecture in simulating MAS, and the use of simulation for studying learning and stigmergic interaction. MAS for Simulation — discusses an agent-based framework for symbiotic simulation, the use of country databases and expert systems for agent-based modeling of social systems, crowd-behavior modeling, agent-based modeling and simulation of adult stem cells, and agents for traffic simulation. Tools — presents a number of representative platforms and tools for MAS and simulation, including Jason, James II, SeSAm, and RoboCup Rescue. Complete with over 200 figures and formulas, this reference book provides the necessary overview of experiences with MAS simulation and the tools needed to exploit simulation in MAS for future research in a vast array of applications including home security, computational systems biology, and traffic management.


Recent Advances in Computational Mechanics and Simulations

Recent Advances in Computational Mechanics and Simulations
Author: Sandip Kumar Saha
Publisher: Springer Nature
Total Pages: 644
Release: 2020-11-13
Genre: Technology & Engineering
ISBN: 9811583153

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This volume presents selected papers from the 7th International Congress on Computational Mechanics and Simulation held at IIT Mandi, India. The papers discuss the development of mathematical models representing physical phenomena and applying modern computing methods and simulations to analyse them. The studies cover recent advances in the fields of nano mechanics and biomechanics, simulations of multiscale and multiphysics problems, developments in solid mechanics and finite element method, advancements in computational fluid dynamics and transport phenomena, and applications of computational mechanics and techniques in emerging areas. The volume will be of interest to researchers and academics from civil engineering, mechanical engineering, aerospace engineering, materials engineering/science, physics, mathematics and other disciplines.


Computational Modeling And Simulations Of Biomolecular Systems

Computational Modeling And Simulations Of Biomolecular Systems
Author: Benoit Roux
Publisher: World Scientific
Total Pages: 209
Release: 2021-08-23
Genre: Computers
ISBN: 9811232776

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This textbook originated from the course 'Simulation, Modeling, and Computations in Biophysics' that I have taught at the University of Chicago since 2011. The students typically came from a wide range of backgrounds, including biology, physics, chemistry, biochemistry, and mathematics, and the course was intentionally adapted for senior undergraduate students and graduate students. This is not a highly technical book dedicated to specialists. The objective is to provide a broad survey from the physical description of a complex molecular system at the most fundamental level, to the type of phenomenological models commonly used to represent the function of large biological macromolecular machines.The key conceptual elements serving as building blocks in the formulation of different levels of approximations are introduced along the way, aiming to clarify as much as possible how they are interrelated. The only assumption is a basic familiarity with simple mathematics (calculus and integrals, ordinary differential equations, matrix linear algebra, and Fourier-Laplace transforms).


Numerical Simulation in Molecular Dynamics

Numerical Simulation in Molecular Dynamics
Author: Michael Griebel
Publisher: Springer Science & Business Media
Total Pages: 472
Release: 2007-08-16
Genre: Science
ISBN: 3540680950

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This book details the necessary numerical methods, the theoretical background and foundations and the techniques involved in creating computer particle models, including linked-cell method, SPME-method, tree codes, amd multipol technique. It illustrates modeling, discretization, algorithms and their parallel implementation with MPI on computer systems with distributed memory. The text offers step-by-step explanations of numerical simulation, providing illustrative code examples. With the description of the algorithms and the presentation of the results of various simulations from fields such as material science, nanotechnology, biochemistry and astrophysics, the reader of this book will learn how to write programs capable of running successful experiments for molecular dynamics.