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Numerical Simulation in Molecular Dynamics: Numerics, Algorithms, Parallelization, Applications: 5 (Texts in Computational Science and Engineering, 5) - Hardcover
Book 3 of 29: Texts in Computational Science and Engineering
Synopsis
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.
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About the Author
Prof. Dr. Hans-Joachim Bungartz ist Professor für Informatik (Simulation großer Systeme) an der Universität Stuttgart. Prof. Dr. Michael Griebel hat eine Professur für Wissenschaftliches Rechnen am Institut für Angewandte Mathematik der Universität Bonn. Prof. Dr. Christoph Zenger ist Professor für Ingenieuranwendungen in der Informatik und numerische Programmierung am Institut für Informatik der TU München.
From the Back Cover
Particle models play an important role in many applications in physics, chemistry and biology. They can be studied on the computer with the help of molecular dynamics simulations. This book presents in detail both the necessary numerical methods and techniques (linked-cell method, SPME-method, tree codes, multipole technique) and the theoretical background and foundations. It illustrates the aspects modelling, discretization, algorithms and their parallel implementation with MPI on computer systems with distributed memory. Furthermore, detailed explanations are given to the different steps of numerical simulation, and code examples are provided. With the description of the algorithms and the presentation of the results of various simulations from the areas material science, nanotechnology, biochemistry and astrophysics, the reader of this book will be able to write his own programs for molecular dynamics step by step and to run successful experiments.
"About this title" may belong to another edition of this title.
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Numerical Simulation in Molecular Dynamics: Numerics, Algorithms, Parallelization, Applications (Texts in Computational Science and Engineering, 5)
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Springer (edition 2007), 2007
ISBN 10: 3540680942
ISBN 13: 9783540680949
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Numerical Simulation in Molecular Dynamics : Numerics, Algorithms, Parallelization, Applications
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Springer Berlin / Heidelberg, 2007
ISBN 10: 3540680942
ISBN 13: 9783540680949
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Numerical Simulation in Molecular Dynamics: Numerics, Algorithms, Parallelization, Applications (Texts in Computational Science and Engineering, 5)
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Numerical Simulation in Molecular Dynamics: Numerics, Algorithms, Parallelization, Applications
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Springer-Verlag Berlin and Heidelberg GmbH & Co. K, 2007
ISBN 10: 3540680942
ISBN 13: 9783540680949
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Numerical Simulation in Molecular Dynamics: Numerics, Algorithms, Parallelization, Applications (Texts in Computational Science and Engineering, 5)
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Numerical Simulation in Molecular Dynamics
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Springer Berlin Heidelberg Aug 2007, 2007
ISBN 10: 3540680942
ISBN 13: 9783540680949
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Buch. Condition: Neu. This item is printed on demand - it takes 3-4 days longer - Neuware -Particle models play an important role in many applications in physics, chemistry and biology. They can be studied on the computer with the help of molecular dynamics simulations. This book presents in detail both the necessary numerical methods and techniques (linked-cell method, SPME-method, tree codes, multipole technique) and the theoretical background and foundations. It illustrates the aspects modelling, discretization, algorithms and their parallel implementation with MPI on computer systems with distributed memory. Furthermore, detailed explanationsare given to the different steps of numerical simulation, and code examples are provided. With the description of the algorithms and the presentation of the results of various simulations from the areas material science, nanotechnology, biochemistry and astrophysics, the reader of this book will be able to write his own programs for molecular dynamics step by step and to run successful experiments. 492 pp. Englisch. Seller Inventory # 9783540680949
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Numerical Simulation in Molecular Dynamics: Numerics, Algorithms, Parallelization, Applications (Texts in Computational Science and Engineering, 5)
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Numerical Simulation in Molecular Dynamics: Numerics, Algorithms, Parallelization, Applications (Texts in Computational Science and Engineering, 5)
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Numerical Simulation in Molecular Dynamics : Numerics, Algorithms, Parallelization, Applications
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Numerical Simulation in Molecular Dynamics
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ISBN 13: 9783540680949
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