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Chemical Reaction Kinetics: Concepts, Methods and Case Studies

Chemical Reaction Kinetics: Concepts, Methods and Case Studies

Autorzy
Wydawnictwo Wiley & Sons
Data wydania
Liczba stron 304
Forma publikacji książka w twardej oprawie
Język angielski
ISBN 9781119226642
Kategorie Kataliza
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Opis książki

A practical approach to chemical reaction kinetics--from basic concepts to laboratory methods--featuring numerous real-world examples and case studiesThis book focuses on fundamental aspects of reaction kinetics with an emphasis on mathematical methods for analyzing experimental data and interpreting results. It describes basic concepts of reaction kinetics, parameters for measuring the progress of chemical reactions, variables that affect reaction rates, and ideal reactor performance. Mathematical methods for determining reaction kinetic parameters are described in detail with the help of real-world examples and fully-worked step-by-step solutions. Both analytical and numerical solutions are exemplified.The book begins with an introduction to the basic concepts of stoichiometry, thermodynamics, and chemical kinetics. This is followed by chapters featuring in-depth discussions of reaction kinetics; methods for studying irreversible reactions with one, two and three components; reversible reactions; and complex reactions. In the concluding chapters the author addresses reaction mechanisms, enzymatic reactions, data reconciliation, parameters, and examples of industrial reaction kinetics. Throughout the book industrial case studies are presented with step-by-step solutions, and further problems are provided at the end of each chapter.* Takes a practical approach to chemical reaction kinetics basic concepts and methods* Features numerous illustrative case studies based on the author's extensive experience in the industry* Provides essential information for chemical and process engineers, catalysis researchers, and professionals involved in developing kinetic models* Functions as a student textbook on the basic principles of chemical kinetics for homogeneous catalysis* Describes mathematical methods to determine reaction kinetic parameters with the help of industrial case studies, examples, and step-by-step solutionsChemical Reaction Kinetics is a valuable working resource for academic researchers, scientists, engineers, and catalyst manufacturers interested in kinetic modeling, parameter estimation, catalyst evaluation, process development, reactor modeling, and process simulation. It is also an ideal textbook for undergraduate and graduate-level courses in chemical kinetics, homogeneous catalysis, chemical reaction engineering, and petrochemical engineering, biotechnology.

Chemical Reaction Kinetics: Concepts, Methods and Case Studies

Spis treści

PrefaceChapter 1. Fundamentals of chemical reaction kinetics1.1. Concepts of stoichiometry1.1.1. Stoichiometric number and coefficient1.1.2. Molecularity1.1.3. Reaction extent1.1.4. Molar conversion1.1.5. Types of feed composition in a chemical reaction1.1.6. Limiting reactant1.1.7. Molar balance in a chemical reaction1.1.8. Relationship between conversion and physical properties of the reacting system1.2. Reacting systems1.2.1. Mole fraction, weight fraction and molar concentration1.2.2. Partial pressure1.2.3. Isothermal systems at constant density1.2.4. Isothermal systems at variable density1.2.5. General case of reacting systems1.2.6. Kinetic point of view of the chemical equilibrium1.3. Concepts of chemical kinetics1.3.1. Rate of homogeneous reactions1.3.2. Power law1.3.3. Elemental and non-elemental reactions1.3.4. Comments on the concepts of molecularity and reaction order1.3.5. Dependency of k with temperature1.4. Description of ideal reactors1.4.1. Batch reactor1.4.2. Continuous reactorsChapter 2. Irreversible reactions of one component2.1. Integral method2.1.1. Reactions of zero order2.1.2. Reactions of first order2.1.3. Reaction of second order2.1.4. Reactions of nth order2.2. Differential method2.2.1. Numerical differentiation2.2.2. Graphical differentiation2.3. Method of total pressure2.3.1. Reactions of zero order2.3.2. Reactions of first order2.3.3. Reactions of second order2.3.4. Reactions of nth order2.3.5. Differential method with data of total pressure2.4. Method of the half-life time2.4.1. Reactions of zero order2.4.2. Reactions of first order2.4.3. Reaction of second order2.4.4. Reaction of nth order2.4.5. Direct method to calculate k and n with data of t1/22.4.6. Extension of the method of half-life time (t1/2) to any fractional life time (t1/m)2.4.7. Calculation of activation energy with data of half-life time2.4.8. Some observations of the method of half-life timeChapter 3. Irreversible reactions with two or three components3.1. Irreversible reactions with two components3.1.1. Integral method3.1.2. Differential method3.1.3. Method of initial reaction rates3.2. Irreversible reactions between three componentsChapter 4. Reversible reactions4.1. Reversible reactions of first order4.2. Reversible reactions of second order4.3. Reversible reactions with combined ordersChapter 5. Complex reactions5.1. Yield and selectivity5.2. Simultaneous or parallel irreversible reactions5.2.1. Simultaneous reactions with the same order5.2.2. Simultaneous reactions with combined orders5.3. Consecutive or in series irreversible reactions5.3.1. Consecutive reactions with the same order5.3.2. Consecutive reactions with combined ordersChapter 6. Special topics in kinetic modeling6.1. Data reconciliation6.1.1. Data reconciliation method6.1.2. Results and discussion6.1.3. Conclusions6.2. Methodology for sensitivity analysis of parameters6.2.1. Description of the method6.2.2. Results and discussion6.2.3. Conclusions6.3. Methods for determining rate coefficients in enzymatic catalyzed reactions6.3.1. The model of Michaelis-Menten6.3.2. Methods to determine the rate coefficients of the Michaelis-Menten equation6.3.3. Application of the methods6.3.4. Discussion of results6.3.5. Conclusions6.4. A simple method for estimating gasoline, gas and coke yields in FCC processes6.4.1. Introduction6.4.2. Methodology6.4.3. Results and discussion6.4.4 Conclusions6.5. Estimation of activation energies during hydrodesulfurization of middle distillates6.5.1. Introduction6.5.2. Experimental6.5.3. Results and discussion6.5.4. ConclusionsProblemsReferencesNomenclature

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