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Computer Simulation in Chemical Physics
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Computer Simulation in Chemical Physics : Proceedings of the NATO Advanced Study Institute on "New Perspectives in Computer Simulation in Chemical Physics"

Book Details

Format Hardback
ISBN-10 0792322835
ISBN-13 9780792322832
Publisher Kluwer Academic Publishers
Imprint Kluwer Academic Publishers
Country of Manufacture GB
Country of Publication GB
Publication Date Apr 30th, 1993
Print length 532 Pages
Weight 910 grams
Dimensions 24.40 x 16.30 x 3.50 cms
Product Classification: PhysicsPhysical chemistry
KSh 12,950.00
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Proceedings of a NATO Study Institute held in Sardinia in 1992, which examined advances that have significantly expanded the scope of the methods. Those such as the Car-Parrinello method, and the Gibbs technique for the direct simulation of liquid vapour phase equilibria are covered in this text.
Preface. 1. The Monte Carlo Method; D.J. Tildesley. 2. The Molecular Dynamics Method; D.J. Tildesley. 3. Back to Basics; M.P. Allen. 4. Advanced Monte Carlo Techniques; D. Frenkel. 5. Thermodynamic Constraints; M. Ferrario. 6. Computer Simulations in the Gibbs Ensemble; B. Smit. 7. Effective Pair Potentials and Beyond; M. Sprik. 8. First-Principles Molecular Dynamics; G. Galli, A. Pasquarello. 9. Computer Simulation Methods for Nonadiabatic Dynamics in Condensed Systems; D.F. Coker. 10. Long Length-Scale Aspects of Self-Organization Phenomena; K.A. Dawson. 11. Computer Simulation of Polymers; K. Kremer. 12. Computer Simulations of Surfactants; B. Smit. 13. Parallel Computing and Molecular Dynamics Simulations; P.A.J. Hilbers, K. Esselink. 14. Scientific Visualization, a User View; M. Ferrario. List of Posters. Index.

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