Molecular Dynamics Simulation: Elementary Methods Paperback - 1997 - 1st Edition
by J. M. Haile
First line
Molecular dynamics simulations compute the motions of individual molecules in models of solids, liquids, and gases.
From the rear cover
"Provides a lot of reading pleasure and many new insights." -Journal of Molecular Structure "This is the most entertaining, stimulating and useful book which can be thoroughly recommended to anyone with an interest in computer simulation." -Contemporary Physics "A very useful introduction . . . more interesting to read than the often dry equation-based texts." -Journal of the American Chemical Society Written especially for the novice, Molecular Dynamics Simulation demonstrates how molecular dynamics simulations work and how to perform them, focusing on how to devise a model for specific molecules and then how to simulate their movements using a computer. This book provides a collection of methods that until now have been scattered through the literature of the last 25 years. It reviews elements of sampling theory and discusses how modern notions of chaos and nonlinear dynamics explain the workings of molecular dynamics. Stresses easy-to-use molecules
* Provides sample calculations and figures
* Includes four complete FORTRAN codes
Details
- Title Molecular Dynamics Simulation: Elementary Methods
- Author J. M. Haile
- Binding Paperback
- Edition number 1st
- Edition 1
- Pages 512
- Volumes 1
- Language ENG
- Publisher Wiley-Interscience, USA
- Date 1997-03-14
- ISBN 9780471184393 / 047118439X
- Weight 1.57 lbs (0.71 kg)
- Dimensions 9.18 x 6.18 x 1.11 in (23.32 x 15.70 x 2.82 cm)
- Library of Congress Catalog Number 91031963
- Dewey Decimal Code 532
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