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Numerical Simulation in Molecular Dynamics: Numerics, Algorithms, Parallelization, Applications

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Numerical Simulation in Molecular Dynamics: Numerics, Algorithms, Parallelization, Applications - Griebel, Michael, and Knapek, Stephan, and Zumbusch, Gerhard
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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. ...

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Numerical Simulation in Molecular Dynamics: Numerics, Algorithms, Parallelization, Applications 2010, Springer-Verlag Berlin and Heidelberg GmbH & Co. K, Berlin

ISBN-13: 9783642087769

Paperback

Numerical Simulation in Molecular Dynamics: Numerics, Algorithms, Parallelization, Applications 2007, Springer, Berlin, Heidelberg

ISBN-13: 9783540680949

2007 edition

Hardcover