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

by Stephan Knapek, Michael Griebel, Gerhard Zumbusch

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...

• Format: Hardcover
• Language: English
• ISBN: 3540680942
• ISBN13: 9783540680949
• Release Date: August 2007
• Publisher: Springer
• Length: 476 Pages
• Weight: 1.70 lbs.
• Dimensions: 0.9" x 6.3" x 9.3"