Search

This book examines the foundational theories of chemical kinetics. The first part covers gas-phase kinetics, while the second focuses on reactions in solution. Expounding on the theory, the book explains calculation procedures in detail using modern computational tools, enabling students to directly apply the theories described. Additional chapters and appendices provide background material necessary to apply these theories. Accompanied by detailed examples using Gaussian (with GaussView) and Matlab, this practical hands-on book provides a first step towards doing more sophisticated calculations as part of a research project. Aimed at senior undergraduate and graduate students, this book focuses on theories that provide insights into basic physical principles that govern the rates of chemical reactions. Key Features: A modern, hands-on approach to learning chemical kinetic theory Teaches both gas-phase and solution-phase theories Minimal background assumed beyond a basic introductory physical chemistry course Strong emphasis on practical computational methods using Matlab, Gaussian and GaussView Detailed instruction provided for both quantum chemical calculations and computer programming exercises

Calculations in Chemical Kinetics for Undergraduates aims to restore passion for problem solving and applied quantitative skills in undergraduate chemistry students. Avoiding complicated chemistry jargon and providing hints and step wise explanations in every calculation problem, students are able to overcome their fear of handling mathematically applied problems in physical chemistry. This solid foundation in their early studies will enable them to connect fundamental theoretical chemistry to real experimental applications as graduates. Additional Features Include: Contains quantitative problems from popular physical chemistry references. Provides step by step explanations are given in every calculation problem. Offers hints to certain problems as'points to note'to enable student comprehension. Includes solutions for all questions and exercises. This book is a great resource for undergraduate chemistry students however, the contents are rich and useful to even the graduate chemist that has passion for applied problems in physical chemistry of reaction Kinetics.

This manual of solutions to the problems in'Kinetics of Catalytic Reactions'has been prepared to assist those who use this book in a teaching function. However, these solutions should also benefit those outside the classroom who want to apply the principles and concepts that are discussed in the book. By studying and observing the approaches used in solving these problems, it is very likely that similar applications can be envisioned in different kinetic problems that the investigator might face. Thus the availability ofthese solutions is a good learning tool for everyone. Additional details and insight about the solutions provided can be obtained by reading the cited references. I have tried to eliminate all errors, both conceptual and typographical, in these solutions; however, the probability is high that I have not succeeded completely. Should any errors of commission (or omission) be found, I would greatly appreciate being informed. I can be reached at this email address: mavche@engr.psu.edu, or mail can be sent to me at: 107 Fenske Laboratory, Department of Chemical Engineering, The Pennsylvania State University, University Park, PA 16802. Albert Vannice v Contents Preface v Solutions to Problems Chapter 3 - Catalyst Characterization.