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Inhaltsangabe
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.
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.
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