Modeling Chemical Systems Using Cellular Automata : A textbook and laboratory manual

Molecular Modeling using Cellular Automata provides a practical introduction to an exciting modeling paradigm for complex systems. The book first discusses the nature of scientific inquiry using models and simulations, and then describes the nature of cellular automata models. It then gives detailed...

Mô tả đầy đủ

Đã lưu trong:
Chi tiết về thư mục
Tác giả chính: Kier, Lemont Burwell, 1930-
Tác giả khác: Cheng, Chao-Kun, Seybold, Paul G.
Định dạng: Livre numérique
Ngôn ngữ:Anglais
Được phát hành: Dordrecht : Springer Netherlands 2005.
Cham : Springer Nature
Truy cập trực tuyến:Accès sur la plateforme éditeur
Accès sur la plateforme Istex
Accès Université d'Orléans
Accès INSA CVL
Chú thích: Archives Springer e-books (Licence nationale)
Archives Springer e-books (Licence nationale)
Autres localisations: Voir dans le Sudoc
Edition sous un autre format:• Cellular automata modeling of chemical systems, a textbook and laboratory manual, Lemont B. Kier, Paul G. Seybold, Chao-Kun Cheng, Dordrecht, Springer, 2005, 1 Vol. (viii, 175 p.), 1-4020-3657-4
Mục lục:
  • Preface Modeling Nature: The System. States of the System. Models in Chemistry Cellular Automata: What are Cellular Automata. The Grid and the Cells. The Rules. Running a Simulation. The Output. Putting it all Together. Applications Water as a System: Experimental Design. The Movement Rules. The Attributes Recorded. Other Liquids. Applications Solution Systems: The Rules. Applications Dynamic Aqueous Systems: Oil-Water Demixing. Micelle Formation. Crystal Formation. Percolation Water Surface Effects: Water-Surface Encounters. Chromatography. Membrane Permeability First Order Chemical Kinetics: Exponential Decay. First Order Equilibrium. Series Reactions. Parallel Reactions. Kinetic and Thermodynamic Reaction Control Second Order Chemical Kinetics: Second Order Models Additional Applications in Chemical Kinetics: Enzyme Kinetics. Liquid-Vapor Equilibrium Use of the CASim Program: The System and Program. Organization of the CA Program. Setting up a Simulation Index CD-ROM included