Modeling of Chemical Reactions

• Author : R.W. Carr
• Publisher : Elsevier
• Release : 04 September 2007

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

• Author : R.W. Carr
• Publisher : Elsevier Science
• Release : 01 November 2007

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

• Author : Péter Érdi,János Tóth
• Publisher : Manchester University Press
• Release : 20 May 1989

• Author : Said S.E.H. Elnashaie,Parag Garhyan
• Publisher : CRC Press
• Release : 26 March 2003

Presenting strategies in control policies, this text uses a systems theory approach to predict, simulate and streamline plant operation, conserve fuel and resources, and increase workplace safety in the manufacturing, chemical, petrochemical, petroleum, biochemical and energy industries. Topics of discussion include system theory and chemical/biochemical engineering systems, steady state, unsteady state, and thermodynamic equilibrium, modeling of systems, fundamental laws governing the processes in terms of the state variables, different classifications of physical models, the story of chemical engineering in

• Author : K.H. Ebert,P. Deuflhard,W. Jäger
• Publisher : Springer Science & Business Media
• Release : 06 December 2012

For rather a long time numerical results in chemical kinetics could only be obtained for very simple chemical reactions, most of which were of minor practi ca 1 importance. The avail abil ity of fast computers has provi ded new opportunities for developments in chemical kinetics. Chemical systems of practical interest are usually very complicated. They consi st of a great number of different el ementary chemi cal reacti ons, mostly with rate constants differi ng by many orders of magni

• Author : Norwegian Institute of Technology. Division of Thermodynamics
• Publisher : Unknown
• Release : 20 May 1989

• Author : Antonio Laganà,György Lendvay
• Publisher : Springer Science & Business Media
• Release : 28 March 2006

Proceedings of the NATO Advanced Research Workshop, held in Balatonföldvár, Hungary, 8-12 June 2003

• Author : Dina Gutkowicz-Krusin
• Publisher : Unknown
• Release : 20 May 1977

• Author : Denis Constales,Gregory S. Yablonsky,Dagmar R. D'hooge,Joris W. Thybaut,Guy B. Marin
• Publisher : Elsevier
• Release : 23 August 2016

Advanced Data Analysis and Modeling in Chemical Engineering provides the mathematical foundations of different areas of chemical engineering and describes typical applications. The book presents the key areas of chemical engineering, their mathematical foundations, and corresponding modeling techniques. Modern industrial production is based on solid scientific methods, many of which are part of chemical engineering. To produce new substances or materials, engineers must devise special reactors and procedures, while also observing stringent safety requirements and striving to optimize the efficiency

• Author : Oleg N. Temkin,Andrew V. Zeigarnik,D.G. Bonchev
• Publisher : CRC Press
• Release : 25 July 2020

Over the last decade, increased attention to reaction dynamics, combined with the intensive application of computers in chemical studies, mathematical modeling of chemical processes, and mechanistic studies has brought graph theory to the forefront of research. It offers an advanced and powerful formalism for the description of chemical reactions and their intrinsic reaction mechanisms. Chemical Reaction Networks: A Graph-Theoretical Approach elegantly reviews and expands upon graph theory as applied to mechanistic theory, chemical kinetics, and catalysis. The authors explore various

• Author : Niels E. Henriksen,Flemming Y. Hansen
• Publisher : Oxford University Press, USA
• Release : 08 November 2018

This book deals with a central topic at the interface of chemistry and physics--the understanding of how the transformation of matter takes place at the atomic level. Building on the laws of physics, the book focuses on the theoretical framework for predicting the outcome of chemical reactions. The style is highly systematic with attention to basic concepts and clarity of presentation. The emphasis is on concepts and insights obtained via analytical theories rather than computational and numerical aspects. Molecular reaction

• Author : Bertram K.C. Chan
• Publisher : Elsevier
• Release : 16 January 2020

Simultaneous Mass Transfer and Chemical Reactions in Engineering Science: Solution Methods and Chemical Engineering Applications illustrates how mathematical analyses, statistics, numerical analysis and computer programming can summarize simultaneous mass transfer and chemical reactions in engineering science for use in solving problems in quantitative Chemical and Biochemical Engineering design and analysis. The book provides statistical methodologies and R recipes for advective and diffusive problems in various geometrical configurations. The R-package ReacTran is used to showcase transport models in aquatic systems (rivers,

• Author : J. R. Bourne,W. Regenass,W. Richarz
• Publisher : Elsevier
• Release : 22 October 2013

ISCRE 10 Tenth International Symposium on Chemical Reaction Engineering documents the proceedings of the symposium which brought together experts from all over the world to discuss developments in CRE. Efforts were made to cover high added value substances and to encourage papers from industry. Some success was achieved, but there remain significant gaps between Chemists and Chemical Engineers when considering high added value products as well as between researchers and practitioners of CRE. The volume begins with plenary papers covering topics

• Author : James S. Ultman,Harihara Baskaran,Gerald M. Saidel
• Publisher : John Wiley & Sons
• Release : 27 April 2016

Teaches the fundamentals of mass transport with a unique approach emphasizing engineering principles in a biomedical environment Includes a basic review of physiology, chemical thermodynamics, chemical kinetics, mass transport, fluid mechanics and relevant mathematical methods Teaches engineering principles and mathematical modelling useful in the broad range of problems that students will encounter in their academic programs as well as later on in their careers Illustrates principles with examples taken from physiology and medicine or with design problems involving biomedical devices

• Author : James John Carberry
• Publisher : CRC Press
• Release : 26 August 2020

This book presents an authoritative progress report that will remain germane to the topic and prove to be a substantial inspiration to further progress. It is valuable to academic and industrial practitioners of the art and science of chemical reaction and reactor engineering.