Elementary Kinetic Modelling in Catalytic Reaction Engineering

Elementary Kinetic Modelling in Catalytic Reaction Engineering is a practical focused text that brings together the relevant basics for reaction engineering and shows their applications to a wide variety of examples, whilst looking at the intrinsic kinetics data acquisition, reaction mechanism elucidation, elementary step-based modelling and model-based design and optimization involved. The book aims at spanning the entire process from acquisition of the relevant data in dedicated experimental set-ups, over the proper treatment of the data and the corresponding interpretation up to the quantification of the gained understanding in a model. The latter aspect allows the reader to challenge the interpretation made of the data and design subsequent experiments or improve the interpretation/model formulation. The coverage is not just limited to the generic (theoretical) principles but will also carefully consider and explain their application to a variety of real-life applications including gas- and liquid-phase reactions, heterogeneously catalyzed reactions involving adsorption either in the Henry regime or at full saturation of the catalyst or combined homogeneous-heterogeneous reactions. Elementary Kinetic Modelling in Catalytic Reaction Engineering is written primarily for graduate students and postdoc researchers in chemical engineering or applied industrial chemistry studying chemical reaction engineering and catalysis, as well as physical chemists studying kinetics. Conveys how relevant information for the optimization of chemical reactions can be acquired through modelling and simulation of the kinetics involvedProvides a complete path from the acquisition of experimental data, to its interpretation and the development of a predictive kinetic modelReaders are provided with concrete guidelines on how to approach experimental efforts, how to systematically interpret data and correspondingly formulate a kinetic modelCase studies cover a range of interesting practical possibilities for chemical reaction engineering INDICE: Part I: Modelling and Simulation Methodologies1. Chemical reactions and reactors2. Acquisition of data containing the relevant information for model construction3. Data treatment and analysis4. Rate equation derivation5. Complex reaction networks6. Rate and equilibrium coefficient determination7. Model exploitationSection II: Applied Case Studies8. Gas phase heterogeneously catalysed reaction: butanediol dehydration9. Liquid phase reaction: (trans)esterification reactions10. Three-phase reaction: hydrogenation/hydrotreatment11. Adsorption effects: from Langmuir adsorption in the Henry regime over saturation effects in solid materials to swelling phenomena in resins12. Combined homogeneous/heterogeneous reactions: oxidative coupling of methane13. Relevant reactor scales14. Relevant phenomena: internal transport limitations, interphase transport limitations

• ISBN: 978-0-443-24032-4
• Editorial: Academic Press
• Encuadernacion: Rústica
• Páginas: 512
• Fecha Publicación: 01/03/2025
• Nº Volúmenes: 1
• Idioma: Inglés