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Author | : Levon Agasievich Tavadi︠a︡n |
Publisher | : Nova Science Publishers |
Total Pages | : 235 |
Release | : 2014-09-06 |
Genre | : Chemical kinetics |
ISBN | : 9781633210813 |
Download Analysis of Kinetic Models of Chemical Reaction Systems Book in PDF, ePub and Kindle
This book presents the results of the study in the field of kinetic and numerical simulation of complex (multistep) chemical reactions. Numerical analysis methods of kinetic models of multistep chemical reactions are elucidated. Also the new value method
Author | : L. A. Tavadian |
Publisher | : Nova Science Publishers |
Total Pages | : 0 |
Release | : 2014 |
Genre | : Chemical kinetics |
ISBN | : 9781631178658 |
Download Analysis of Kinetic Models of Chemical Reaction Systems Book in PDF, ePub and Kindle
This book presents the results of the study in the field of kinetic and numerical simulation of complex (multistep) chemical reactions. Numerical analysis methods of kinetic models of multistep chemical reactions are elucidated. Also the new value method of computerized study of the kinetic models of reaction systems is proposed which is distinguished by calculation simplicity, clearness, interpretability of obtained results in the terms of physics and chemistry, and in a variety of solved tasks. The given method of investigations is based on the Hamiltonian systematization of reaction mechanisms which reveals the value (kinetic significance) of individual steps and species, and, as a result, determination of the rational ways to control chemical reactions. The value of individual steps and species is determined as a ratio of the response of selected characteristic dynamic magnitude of a chemical reaction system in a certain point of time to the small disturbance of the rate of individual step and the rate-of-production of species accumulation in the initial point of time.
Author | : Tamás Turányi |
Publisher | : Springer |
Total Pages | : 369 |
Release | : 2014-12-29 |
Genre | : Science |
ISBN | : 366244562X |
Download Analysis of Kinetic Reaction Mechanisms Book in PDF, ePub and Kindle
Chemical processes in many fields of science and technology, including combustion, atmospheric chemistry, environmental modelling, process engineering, and systems biology, can be described by detailed reaction mechanisms consisting of numerous reaction steps. This book describes methods for the analysis of reaction mechanisms that are applicable in all these fields. Topics addressed include: how sensitivity and uncertainty analyses allow the calculation of the overall uncertainty of simulation results and the identification of the most important input parameters, the ways in which mechanisms can be reduced without losing important kinetic and dynamic detail, and the application of reduced models for more accurate engineering optimizations. This monograph is invaluable for researchers and engineers dealing with detailed reaction mechanisms, but is also useful for graduate students of related courses in chemistry, mechanical engineering, energy and environmental science and biology.
Author | : R.W. Carr |
Publisher | : Elsevier |
Total Pages | : 317 |
Release | : 2007-09-04 |
Genre | : Science |
ISBN | : 008054617X |
Download Modeling of Chemical Reactions Book in PDF, ePub and Kindle
Modeling of Chemical Reactions covers detailed chemical kinetics models for chemical reactions. Including a comprehensive treatment of pressure dependent reactions, which are frequently not incorporated into detailed chemical kinetic models, and the use of modern computational quantum chemistry, which has recently become an extraordinarily useful component of the reaction kinetics toolkit. It is intended both for those who need to model complex chemical reaction processes but have little background in the area, and those who are already have experience and would benefit from having a wide range of useful material gathered in one volume. The range of subject matter is wider than that found in many previous treatments of this subject. The technical level of the material is also quite wide, so that non-experts can gain a grasp of fundamentals, and experts also can find the book useful. A solid introduction to kinetics Material on computational quantum chemistry, an important new area for kinetics Contains a chapter on construction of mechanisms, an approach only found in this book
Author | : A. Kayode Coker |
Publisher | : Gulf Professional Publishing |
Total Pages | : 1132 |
Release | : 2001-07-26 |
Genre | : Science |
ISBN | : 9780884154815 |
Download Modeling of Chemical Kinetics and Reactor Design Book in PDF, ePub and Kindle
This reference conveys a basic understanding of chemical reactor design methodologies that incorporate both control and hazard analysis. It demonstrates how to select the best reactor for any particular chemical reaction, and how to estimate its size to determine the best operating conditions.
Author | : Péter Érdi |
Publisher | : Manchester University Press |
Total Pages | : 296 |
Release | : 1989 |
Genre | : Chemical reactions |
ISBN | : 9780719022081 |
Download Mathematical Models of Chemical Reactions Book in PDF, ePub and Kindle
Author | : R.W. Carr |
Publisher | : Elsevier Science |
Total Pages | : 316 |
Release | : 2007-11-01 |
Genre | : Science |
ISBN | : 9780444513663 |
Download Modeling of Chemical Reactions Book in PDF, ePub and Kindle
Modeling of Chemical Reactions covers detailed chemical kinetics models for chemical reactions. Including a comprehensive treatment of pressure dependent reactions, which are frequently not incorporated into detailed chemical kinetic models, and the use of modern computational quantum chemistry, which has recently become an extraordinarily useful component of the reaction kinetics toolkit. It is intended both for those who need to model complex chemical reaction processes but have little background in the area, and those who are already have experience and would benefit from having a wide range of useful material gathered in one volume. The range of subject matter is wider than that found in many previous treatments of this subject. The technical level of the material is also quite wide, so that non-experts can gain a grasp of fundamentals, and experts also can find the book useful. A solid introduction to kinetics Material on computational quantum chemistry, an important new area for kinetics Contains a chapter on construction of mechanisms, an approach only found in this book
Author | : Guy B. Marin |
Publisher | : John Wiley & Sons |
Total Pages | : 446 |
Release | : 2018-12-07 |
Genre | : Science |
ISBN | : 352780837X |
Download Kinetics of Chemical Reactions Book in PDF, ePub and Kindle
This second, extended and updated edition presents the current state of kinetics of chemical reactions, combining basic knowledge with results recently obtained at the frontier of science. Special attention is paid to the problem of the chemical reaction complexity with theoretical and methodological concepts illustrated throughout by numerous examples taken from heterogeneous catalysis combustion and enzyme processes. Of great interest to graduate students in both chemistry and chemical engineering.
Author | : |
Publisher | : Elsevier |
Total Pages | : 1034 |
Release | : 2019-06-21 |
Genre | : Technology & Engineering |
ISBN | : 0128195797 |
Download Mathematical Modelling of Gas-Phase Complex Reaction Systems: Pyrolysis and Combustion Book in PDF, ePub and Kindle
Mathematical Modelling of Gas-Phase Complex Reaction Systems: Pyrolysis and Combustion, Volume 45, gives an overview of the different steps involved in the development and application of detailed kinetic mechanisms, mainly relating to pyrolysis and combustion processes. The book is divided into two parts that cover the chemistry and kinetic models and then the numerical and statistical methods. It offers a comprehensive coverage of the theory and tools needed, along with the steps necessary for practical and industrial applications. Details thermochemical properties and "ab initio" calculations of elementary reaction rates Details kinetic mechanisms of pyrolysis and combustion processes Explains experimental data for improving reaction models and for kinetic mechanisms assessment Describes surrogate fuels and molecular reconstruction of hydrocarbon liquid mixtures Describes pollutant formation in combustion systems Solves and validates the kinetic mechanisms using numerical and statistical methods Outlines optimal design of industrial burners and optimization and dynamic control of pyrolysis furnaces Outlines large eddy simulation of turbulent reacting flows
Author | : R.W. Carr |
Publisher | : Elsevier Science |
Total Pages | : 316 |
Release | : 2007-11-01 |
Genre | : Science |
ISBN | : 9780444513663 |
Download Modeling of Chemical Reactions Book in PDF, ePub and Kindle
Modeling of Chemical Reactions covers detailed chemical kinetics models for chemical reactions. Including a comprehensive treatment of pressure dependent reactions, which are frequently not incorporated into detailed chemical kinetic models, and the use of modern computational quantum chemistry, which has recently become an extraordinarily useful component of the reaction kinetics toolkit. It is intended both for those who need to model complex chemical reaction processes but have little background in the area, and those who are already have experience and would benefit from having a wide range of useful material gathered in one volume. The range of subject matter is wider than that found in many previous treatments of this subject. The technical level of the material is also quite wide, so that non-experts can gain a grasp of fundamentals, and experts also can find the book useful. A solid introduction to kinetics Material on computational quantum chemistry, an important new area for kinetics Contains a chapter on construction of mechanisms, an approach only found in this book