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Modeling Chemical Systems using Cellular Automata
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...
| Clasificación: | Libro Electrónico |
|---|---|
| Autores principales: | , , |
| Autor Corporativo: | |
| Formato: | Electrónico eBook |
| Idioma: | Inglés |
| Publicado: |
Dordrecht :
Springer Netherlands : Imprint: Springer,
2005.
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| Edición: | 1st ed. 2005. |
| Temas: | |
| Acceso en línea: | Texto Completo |
Tabla de Contenidos:
- 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.