Modelling of Chemical Reaction Systems

Inhaltsverzeichnis

• I Mathematical Treatment.
• 1. The Interaction of Structure and Dynamics in Chemical Reaction Networks.
• 2. Analytic Methods for the Approximate Solution of Singularly Perturbed Systems.
• 3. Numerical Treatment of Rapid Chemical Kinetics by Perturbation and Projection Methods.
• 4. LARKIN — A Software Package for ttie Numerical Simulation of LARge Systems Arising in Chemical Reaction KINetics.
• 5. Reaction Network Structure, Multiple Steady States, and Sustained Composition Oscillations: A Review of Some Results.
• 6. Sensitivity Analysis of Chemically Reacting Systems.
• 7. The Inverse Problem: Estimation of Kinetic Parameters.
• 8. Numerical Treatment of Inverse Problems in Chemical Reaction Kinetics.
• 9. Infinite Period Bifurcation in Simple Chemical Reactors.
• 10. A Molecular Dynamics Technique to Study Fluctuations in Non-Equilibrium Chemical Systems.
• II Physical Chemical Applications.
• 11. Measurement and Estimation of Rate Constants for Modelling Reactive Systems.
• 12. Chemistry of Stationary and Non-Stationary Combustion.
• 13. Modelling of Polymer Degradation Reactions.
• 14. Modelling and Study of Derivative Signal Curves of Complex Chemical Reaction Mechanisms at Constant Heating Rate.
• 15. Large Activation Energy Asymptotics and Turbulent Combustion.
• 16. The Thermal Decomposition of n-Hexane: Kinetics, Mechanism, and Simulation.
• 17. Application of Reaction Networks for Modelling Hydrocarbon Oxidation Processes.
• 18. Transients and Oscillations in Heterogeneous Catalysis.
• 19. Simulation of Heterogeneous: Free Radical Polymerization Reactions.
• 20. Multistability in Flow Systems of the Belousov Zhabotinskii and Related Systems.
• 21. An Old Model as a New Idea in the Modelling of the Oscillation BZ Reaction.
• III Chemical Engineering Applications.
• 22. Modellingand Simulation in Industrial Chemical Reaction Engineering.
• 23. Steady State Multiplicity of Chemically Reacting Systems.
• 24. Non-Linear Wave Propagation and Model Reduction of the Fixed-Bed Reactor.
• 25. Dynamic Behaviour of Polymerization Reactors.
• 26. Chaos in a Continuous Stirred Tank Reactor with Two Consecutive First-Order Reactions, One Exo-, One Endothermic.
• 27. Problems in Modelling the Purex Process.
• IV Summary.
• 28. Summary of the Workshop.
• Contributors.