Kinetics of Multistep Reactions PDF Download
Are you looking for read ebook online? Search for your book and save it on your Kindle device, PC, phones or tablets. Download Kinetics of Multistep Reactions PDF full book. Access full book title Kinetics of Multistep Reactions by Friedrich G. Helfferich. Download full books in PDF and EPUB format.
Author: Friedrich G. Helfferich
Publisher: Elsevier
ISBN: 0080473180
Category : Science
Languages : en
Pages : 508
Get Book
Book Description
This book addresses primarily the engineer in industrial process development, the research chemist in academia and industry, and the graduate student intending to become a reaction engineer. In industry, competitive pressures put a premium on scale-up by large factors to cut development time. To be safe, such development should be based on "fundamental" kinetics that reflect the elementary steps of which the reaction consists. The book forges fundamental kinetics into a practical tool by presenting new, effective methods for elucidation of mechanisms and reduction of complexity without unacceptable sacrifice in accuracy: fewer equations (lesser computational load), fewer coefficients (fewer experiment to determine them). For network elucidation, new rules relating network configurations to observable kinetic behaviour allow incorrect networks to be ruled out by whole classes instead of one by one. For modelling, general equations and algorithms are given from which equations for specific networks can be recovered by simple substitutions. The procedures are illustrated with examples of industrial reactions including, among others, paraffin oxidation, ethoxylation, hydroformylation, hydrocyanation, shape-selective catalysis, ethane pyrolysis, styrene polymerization, and ethene oligomerization. Many of the rate equations have not been published before. The expanded edition of the 2001 title, Kinetics of Homogeneous Multistep Reactions includes new chapters on heterogeneous catalysis and periodic and chaotic re-actions; new sections on adsorption, statistical methods, and lumping; and other new detail. Contains new chapters on heterogeneous catalysis, oscillations and chaos Includes new sections on statistical methods, lumping adsorption and software and databases Provides a better understanding of complex reaction mechanisms
Author: Friedrich G. Helfferich
Publisher: Elsevier
ISBN: 0080473180
Category : Science
Languages : en
Pages : 508
Get Book
Book Description
This book addresses primarily the engineer in industrial process development, the research chemist in academia and industry, and the graduate student intending to become a reaction engineer. In industry, competitive pressures put a premium on scale-up by large factors to cut development time. To be safe, such development should be based on "fundamental" kinetics that reflect the elementary steps of which the reaction consists. The book forges fundamental kinetics into a practical tool by presenting new, effective methods for elucidation of mechanisms and reduction of complexity without unacceptable sacrifice in accuracy: fewer equations (lesser computational load), fewer coefficients (fewer experiment to determine them). For network elucidation, new rules relating network configurations to observable kinetic behaviour allow incorrect networks to be ruled out by whole classes instead of one by one. For modelling, general equations and algorithms are given from which equations for specific networks can be recovered by simple substitutions. The procedures are illustrated with examples of industrial reactions including, among others, paraffin oxidation, ethoxylation, hydroformylation, hydrocyanation, shape-selective catalysis, ethane pyrolysis, styrene polymerization, and ethene oligomerization. Many of the rate equations have not been published before. The expanded edition of the 2001 title, Kinetics of Homogeneous Multistep Reactions includes new chapters on heterogeneous catalysis and periodic and chaotic re-actions; new sections on adsorption, statistical methods, and lumping; and other new detail. Contains new chapters on heterogeneous catalysis, oscillations and chaos Includes new sections on statistical methods, lumping adsorption and software and databases Provides a better understanding of complex reaction mechanisms
Author: Friedrich G. Helfferich
Publisher: Elsevier
ISBN: 0080535267
Category : Technology & Engineering
Languages : en
Pages : 427
Get Book
Book Description
This book addresses primarily the chemist and engineer in industrial research and process development, where competitive pressures put a premium on scale-up by large factors to cut development time. To be safe, such scale-up should be based on "fundamental" kinetics, that is, mathematics that reflect the elementary steps of which the reactions consist. The book forges fundamental kinetics into a practical tool by presenting new effective methods for elucidation of mechanisms and reduction of mathematical complexity without unacceptable sacrifice in accuracy.
Author: Nicholas Green
Publisher: Elsevier
ISBN: 0080543448
Category : Science
Languages : en
Pages : 263
Get Book
Book Description
Unimolecular reactions are in principle the simplest chemical reactions, because they only involve one molecule. The basic mechanism, in which the competition between the chemical reaction step and a collisional deactivation leads to a pressure-dependent coefficient, has been understood for a long time. However, this is a rapidly developing field, and many new and important discoveries have been made in the past decade.This First Part Part of Two CCK Volumes dealing with Unimolecular Rections, deals with the Reaction Step. The first chapter is an introduction to the whole project, aiming to cover the material necessary to understand the content of the detailed chapters, as well as the history of the development of the area. Chapter 2 is a review of the modern view of the statistical theories, as embodied in the various forms of RRKM theory. Chapter 3 deals with the fully quantum mechanical view of reactive states as resonances. . Presents considerable advances in the field made during the last decade.. Treats both the statistical as well as the fully quantum mechanical view.
Author: Baron Peters
Publisher: Elsevier
ISBN: 0444594701
Category : Technology & Engineering
Languages : en
Pages : 634
Get Book
Book Description
Reaction Rate Theory and Rare Events bridges the historical gap between these subjects because the increasingly multidisciplinary nature of scientific research often requires an understanding of both reaction rate theory and the theory of other rare events. The book discusses collision theory, transition state theory, RRKM theory, catalysis, diffusion limited kinetics, mean first passage times, Kramers theory, Grote-Hynes theory, transition path theory, non-adiabatic reactions, electron transfer, and topics from reaction network analysis. It is an essential reference for students, professors and scientists who use reaction rate theory or the theory of rare events. In addition, the book discusses transition state search algorithms, tunneling corrections, transmission coefficients, microkinetic models, kinetic Monte Carlo, transition path sampling, and importance sampling methods. The unified treatment in this book explains why chemical reactions and other rare events, while having many common theoretical foundations, often require very different computational modeling strategies. Offers an integrated approach to all simulation theories and reaction network analysis, a unique approach not found elsewhere Gives algorithms in pseudocode for using molecular simulation and computational chemistry methods in studies of rare events Uses graphics and explicit examples to explain concepts Includes problem sets developed and tested in a course range from pen-and-paper theoretical problems, to computational exercises
Author: Viktor Korobov
Publisher: Springer Science & Business Media
ISBN: 3709105315
Category : Science
Languages : en
Pages : 353
Get Book
Book Description
The authors explain at length the principles of chemical kinetics and approaches to computerized calculations in modern software suites — mathcad and maple. Mathematics is crucial in determining correlations in chemical processes and requires various numerical approaches. Often significant issues with mathematical formalizations of chemical problems arise and many kinetic problems can ́t be solved without computers. Numerous problems encountered in solving kinetics ́ calculations with detailed descriptions of the numerical tools are given. Special attention is given to electrochemical reactions, which fills a gap in existing texts not covering this topic in detail. The material demonstrates how these suites provide quick and precise behavior predictions for a system over time (for postulated mechanisms).Examples, i.e., oscillating and non-isothermal reactions, help explain the use of mathcad more efficiently. Also included are the results of authors’ own research toward effective computations.
Author: Michel Soustelle
Publisher: John Wiley & Sons
ISBN: 1118604229
Category : Science
Languages : en
Pages : 484
Get Book
Book Description
This book is a progressive presentation of kinetics of the chemical reactions. It provides complete coverage of the domain of chemical kinetics, which is necessary for the various future users in the fields of Chemistry, Physical Chemistry, Materials Science, Chemical Engineering, Macromolecular Chemistry and Combustion. It will help them to understand the most sophisticated knowledge of their future job area. Over 15 chapters, this book present the fundamentals of chemical kinetics, its relations with reaction mechanisms and kinetic properties. Two chapters are then devoted to experimental results and how to calculate the kinetic laws in both homogeneous and heterogeneous systems. The following two chapters describe the main approximation modes to calculate these laws. Three chapters are devoted to elementary steps with the various classes, the principles used to write them and their modeling using the theory of the activated complex in gas and condensed phases. Three chapters are devoted to the particular areas of chemical reactions, chain reactions, catalysis and the stoichiometric heterogeneous reactions. Finally the non-steady-state processes of combustion and explosion are treated in the final chapter.
Author: CK-12 Foundation
Publisher: CK-12 Foundation
ISBN: 1935983490
Category : Science
Languages : en
Pages : 995
Get Book
Book Description
CK-12 Foundation's Chemistry - Second Edition FlexBook covers the following chapters:Introduction to Chemistry - scientific method, history.Measurement in Chemistry - measurements, formulas.Matter and Energy - matter, energy.The Atomic Theory - atom models, atomic structure, sub-atomic particles.The Bohr Model of the Atom electromagnetic radiation, atomic spectra. The Quantum Mechanical Model of the Atom energy/standing waves, Heisenberg, Schrodinger.The Electron Configuration of Atoms Aufbau principle, electron configurations.Electron Configuration and the Periodic Table- electron configuration, position on periodic table.Chemical Periodicity atomic size, ionization energy, electron affinity.Ionic Bonds and Formulas ionization, ionic bonding, ionic compounds.Covalent Bonds and Formulas nomenclature, electronic/molecular geometries, octet rule, polar molecules.The Mole Concept formula stoichiometry.Chemical Reactions balancing equations, reaction types.Stoichiometry limiting reactant equations, yields, heat of reaction.The Behavior of Gases molecular structure/properties, combined gas law/universal gas law.Condensed Phases: Solids and Liquids intermolecular forces of attraction, phase change, phase diagrams.Solutions and Their Behavior concentration, solubility, colligate properties, dissociation, ions in solution.Chemical Kinetics reaction rates, factors that affect rates.Chemical Equilibrium forward/reverse reaction rates, equilibrium constant, Le Chatelier's principle, solubility product constant.Acids-Bases strong/weak acids and bases, hydrolysis of salts, pHNeutralization dissociation of water, acid-base indicators, acid-base titration, buffers.Thermochemistry bond breaking/formation, heat of reaction/formation, Hess' law, entropy, Gibb's free energy. Electrochemistry oxidation-reduction, electrochemical cells.Nuclear Chemistry radioactivity, nuclear equations, nuclear energy.Organic Chemistry straight chain/aromatic hydrocarbons, functional groups.Chemistry Glossary
Author: PatrickL. Brezonik
Publisher: Routledge
ISBN: 1351461508
Category : Science
Languages : en
Pages : 540
Get Book
Book Description
Chemical Kinetics and Process Dynamics in Aquatic Systems is devoted to chemical reactions and biogeochemical processes in aquatic systems. The book provides a thorough analysis of the principles, mathematics, and analytical tools used in chemical, microbial, and reactor kinetics. It also presents a comprehensive, up-to-date description of the kinetics of important chemical processes in aquatic environments. Aquatic photochemistry and correlation methods (e.g., LFERs and QSARs) to predict process rates are covered. Numerous examples are included, and each chapter has a detailed bibliography and problems sets. The book will be an excellent text/reference for professionals and students in such fields as aquatic chemistry, limnology, aqueous geochemistry, microbial ecology, marine science, environmental and water resources engineering, and geochemistry.
Author: Dirk Husmeier
Publisher: Springer Science & Business Media
ISBN: 1846281199
Category : Computers
Languages : en
Pages : 511
Get Book
Book Description
Probabilistic Modelling in Bioinformatics and Medical Informatics has been written for researchers and students in statistics, machine learning, and the biological sciences. The first part of this book provides a self-contained introduction to the methodology of Bayesian networks. The following parts demonstrate how these methods are applied in bioinformatics and medical informatics. All three fields - the methodology of probabilistic modeling, bioinformatics, and medical informatics - are evolving very quickly. The text should therefore be seen as an introduction, offering both elementary tutorials as well as more advanced applications and case studies.
Author: Michael Mortimer
Publisher: Royal Society of Chemistry
ISBN: 9780854046706
Category : Education
Languages : en
Pages : 270
Get Book
Book Description
Annotation This book considers the role of the rate of reaction, starting with an introduction to chemical kinetics (measuring rates of reaction, order of reaction, reaction mechanisms). It then illustrates how the outcome of predictions can be made, where this is determined by the reaction rate. The concept of the functional group is introduced and is followed by a discussion of the characteristic reactions of several functional groups and the common mechanisms of organic reactions, substitution and elimination. An interactive CD-ROM accompanies the book. This book is part of The Molecular World series which aims to provide a broad foundation in chemistry.
