Kinetics and Dynamics of Elementary Gas Reactions

Kinetics and Dynamics of Elementary Gas Reactions
Author: Ian W. M. Smith
Publisher: Butterworth-Heinemann
Total Pages: 400
Release: 2013-10-22
Genre: Science
ISBN: 1483161994

Kinetics and Dynamics of Elementary Gas Reactions surveys the state of modern knowledge on elementary gas reactions to understand natural phenomena in terms of molecular behavior. Part 1 of this book describes the theoretical and conceptual background of elementary gas-phase reactions, emphasizing the assumptions and limitations of each theoretical approach, as well as its strengths. In Part 2, selected experimental results are considered to demonstrate the scope of present day techniques and illustrate the application of the theoretical ideas introduced in Part 1. This publication is intended primarily for working kineticists and chemists, but is also beneficial to graduate students.

The Kinetics and Dynamics of Elementary Gas-Phase Reactions

The Kinetics and Dynamics of Elementary Gas-Phase Reactions
Author:
Publisher:
Total Pages: 78
Release: 2002
Genre:
ISBN:

This is an interdisciplinary conference, given in honor of Prof. I.W.M. Smith. Topics include: Reaction Dynamics and Energy Transfer; Gas Kinetics and Atmospheric Chemistry; Astrochemistry Theoretical Chemical Dynamics and Kinetics.

Gas-Phase Reactions

Gas-Phase Reactions
Author: V.N. Kondratiev
Publisher: Springer Science & Business Media
Total Pages: 254
Release: 2012-12-06
Genre: Science
ISBN: 3642676081

The present monograph appears after the death of Professor V. N. Kondratiev, one of those scientists who have greatly contributed to the foundation of contem porary gas kinetics. The most fundamental idea of chemical kinetics, put for ward at the beginning of the twentieth century and connected with names such as W. Nernst, M. Bodenstein, N. N. Semenov, and C. N. Hinshelwood, was that the complex chemical reactions are in fact a manifestation of a set of simpler elementary reactions involving but a small number of species. V. N. Kondratiev was one of the first to adopt this idea and to start investigations on the elementary chemical reactions proper. These investigations revealed explicitly that every elementary reaction in turn consisted of many elementary events usually referred to as elementary processes. It took some time to realize that an elementary reaction, represented in a very simple way by a macroscopic kinetic equation, can be described on a microscopic level by a generalized Boltzmann equation. Neverheless, up to the middle of the twentieth century, gas kinetics was mainly concerned with the interpretation of complex chemical reactions via a set of elementary reactions. But later on, the situation changed drastically. First, the conditions for reducing microscopic cquations to macroscopic ones were clearly set up. These are essentially based on the fact that the small perturbations of the Maxwell-Boltzmann distribution are caused by the reaction proper.

Gas-Phase Thermal Reactions

Gas-Phase Thermal Reactions
Author: Guy-Marie Côme
Publisher: Springer Science & Business Media
Total Pages: 358
Release: 2001-10-31
Genre: Science
ISBN: 9781402000492

This book is dedicated to gas-phase thermal reactions which take place in engines, burners, and industrial reactors for the production of mechanical or thermal energy, for the incineration of pollutants, or for the manufacture of chemicals. It also studies their effect on the environment: fires, explosions, tropospheric pollution, the greenhouse effect, and holes in the ozone layer. After a short reminder of the concepts and laws of thermodynamics, and of chemical and physical kinetics, the book suggests a methodology for the kinetic modelling of these reactions: generation and reduction of reaction mechanisms, estimation of kinetic data of elementary reactions, estimation of the thermodynamic data and transport data of molecules and free radicals, and analysis and validation of mechanisms by comparison of calculated results with the experimental results obtained using laboratory reactors. The models thus generated carry all the information necessary to allow them to be incorporated into computer programs for the calculation of reactors or of the fluid dynamics of reacting gases. Tables of numerical data and a list of computer programs and URLs complete the book.

Reaction Dynamics

Reaction Dynamics
Author: Mark Brouard
Publisher:
Total Pages: 0
Release: 2023
Genre: Chemical reactions
ISBN: 9780191992278

This text gives a concise account of the dynamics and kinetics of elementary reactions in the gas phase, and is structured to emphasize the relationship between thermal rate coefficients and the microscopic mechanisms of chemical reactions.

Theoretical Studies of Gas Phase Elementary Reactions

Theoretical Studies of Gas Phase Elementary Reactions
Author:
Publisher:
Total Pages: 0
Release: 1998
Genre:
ISBN:

Understanding the mechanism, kinetics and dynamics of elementary gas phase reactions is one of the major goals of chemistry. Such understanding is also essential to predicting and understanding plasma dynamics and optical radiation associated with the spacecraft-atmosphere interactions. The objective of the present research was to provide, based on mainly the ab initio molecular orbital and some dynamics calculations, theoretical information concerning the potential energy surfaces that dictate the kinetics and dynamics of gas phase elementary reactions. The reactions studied include ion-molecule reactions, photochemical reactions and neutral elementary reactions. Many of the systems for which theoretical calculations were performed in the present research are relevant to atmospheric chemistry and chemical lasers. Many systems were chosen based on the experimental studies and in collaboration with scientists at Air Force Research Laboratory, in order to provide them with some new insight that is not easily available without theoretical studies.

An Introduction to the Gas Phase

An Introduction to the Gas Phase
Author: Claire Vallance
Publisher: Morgan & Claypool Publishers
Total Pages: 66
Release: 2017-12-08
Genre: Science
ISBN: 1681746956

An Introduction to the Gas Phase is adapted from a set of lecture notes for a core first year lecture course in physical chemistry taught at the University of Oxford. The book is intended to give a relatively concise introduction to the gas phase at a level suitable for any undergraduate scientist. After defining the gas phase, properties of gases such as temperature, pressure, and volume are discussed. The relationships between these properties are explained at a molecular level, and simple models are introduced that allow the various gas laws to be derived from first principles. Finally, the collisional behavior of gases is used to explain a number of gas-phase phenomena, such as effusion, diffusion, and thermal conductivity.

Reaction Dynamics

Reaction Dynamics
Author: M. Brouard
Publisher: OUP Oxford
Total Pages: 86
Release: 1998-06-25
Genre: Science
ISBN: 9780198559078

Understanding the factors which determine the rates and products of elementary reactions is of fundamental importance to chemists. This informative book contains a concise introductory account of the theoretical framework and experimental methods used to elucidate the detailed mechanism of gas phase elementary reactions.