Computer-Aided Modeling of Reactive Systems

Author: Warren E. Stewart  

Publisher: John Wiley & Sons Inc‎

Publication year: 2008

E-ISBN: 9780470282021

P-ISBN(Hardback):  9780470274958

Subject: Q Biological Sciences

Language: ENG

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Description

Learn to apply modeling and parameter estimation tools and strategies to chemicalprocesses using your personal computer

This book introduces readers to powerful parameter estimation and computational methods for modeling complex chemical reactions and reaction processes. It presents useful mathematical models, numerical methods for solving them, and statistical methods for testing and discriminating candidate models with experimental data. Topics covered include:

Chemical reaction models

Chemical reactor models

Probability and statistics

Bayesian estimation

Process modeling with single-response data

Process modeling with multi-response data

Computer software (Athena Visual Studio) is available via a related Web site http://www.athenavisual.com enabling readers to carry out parameter estimation based on their data and to carry out process modeling using these parameters. As an aid to the reader, an appendix of example problems and solutions is provided.

Computer-Aided Modeling of Reactive Systems is an ideal supplemental text for advanced undergraduates and graduate students in chemical engineering courses, while it also serves as a valuable resource for practitioners in industry who want to keep up to date on the most current tools and strategies available.

Chapter

Chapter 1. Overview

pp.:  1 – 21

Chapter 4. Introduction to Probability and Statistics

pp.:  59 – 85

Chapter 5. Introduction to Bayesian Estimation

pp.:  85 – 97

Chapter 6. Process Modeling with Single-Response Data

pp.:  97 – 115

Chapter 7. Process Modeling with Multiresponse Data

pp.:  115 – 161

Appendix A. Solution of Linear Algebraic Equations

pp.:  161 – 197

Appendix B. DDAPLUS Documentation

pp.:  197 – 209

Appendix C. GREGPLUS Documentation

pp.:  209 – 237

Author Index

pp.:  237 – 279

Subject Index

pp.:  279 – 285

LastPages

pp.:  285 – 288

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