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Books on the topic 'Reaction kinetics/equilibrium'

Author: Grafiati

Published: 4 June 2021

Last updated: 10 February 2022

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1

Radhakrishnan, Krishnan. LSENS, a general chemical kinetics and sensitivity analysis code for homogeneous gas-phase reactions. II. Code description and usage. Cleveland, Ohio: Lewis Research Center, 1994.

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2

Radhakrishnan, Krishnan. LSENS - a general chemical kinetics and sensitivity analysis code for homogeneous gas-phase reactions. I. Theory and numerical solution procedures. Cleveland, Ohio: Lewis Research Center, 1994.

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3

Ruff, F. Organic reactions: Equilibria, kinetics, and mechanism. Amsterdam: Elsevier, 1994.

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4

1923-, Grunwald Ernest, ed. Rates and equilibria of organic reactions as treated by statistical, thermodynamic, and extrathermodynamic methods. New York: Dover Publications, 1989.

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5

Elena, Kustova, Mayinger Franz, Mewes Dieter, and SpringerLink (Online service), eds. Non-Equilibrium Reacting Gas Flows: Kinetic Theory of Transport and Relaxation Processes. Berlin, Heidelberg: Springer Berlin Heidelberg, 2009.

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6

Gallagher, Richard Thomas. Kinetics and equilibria of ion-molecule association reactions: Studied using temperature variable high pressure ion sources. [s.l.]: typescript, 1987.

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7

Sherwood, Dennis, and Paul Dalby. Chemical equilibrium and chemical kinetics. Oxford University Press, 2018. http://dx.doi.org/10.1093/oso/9780198782957.003.0014.

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Building on the previous chapter, this chapter examines gas phase chemical equilibrium, and the equilibrium constant. This chapter takes a rigorous, yet very clear, ‘first principles’ approach, expressing the total Gibbs free energy of a reaction mixture at any time as the sum of the instantaneous Gibbs free energies of each component, as expressed in terms of the extent-of-reaction. The equilibrium reaction mixture is then defined as the point at which the total system Gibbs free energy is a minimum, from which concepts such as the equilibrium constant emerge. The chapter also explores the temperature dependence of equilibrium, this being one example of Le Chatelier’s principle. Finally, the chapter links thermodynamics to chemical kinetics by showing how the equilibrium constant is the ratio of the forward and backward rate constants. We also introduce the Arrhenius equation, closing with a discussion of the overall effect of temperature on chemical equilibrium.

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8

Amnon, Kohen, and Limbach Hans-Heinrich, eds. Isotope effects in chemistry and biology. Boca Raton: Taylor & Francis, 2006.

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9

Isotope Effects In Chemistry and Biology. CRC, 2005.

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10

Kam-Pui, Lee, Gupta Roop N, and Langley Research Center, eds. Computer codes for the evaluation of thermodynamic properties, transport properties, and equilibrium constants of an 11-species air model. Hampton, Va: National Aeronautics and Space Administration, Langley Research Center, 1990.

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11

Saxena, S. K. Kinetics and Equilibrium in Mineral Reactions. Springer, 2013.

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12

Organic Reactions - Equilibria, Kinetics and Mechanism. Elsevier, 1994. http://dx.doi.org/10.1016/c2009-0-10268-4.

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13

Nagnibeda, Ekaterina, and Elena Kustova. Non-Equilibrium Reacting Gas Flows: Kinetic Theory of Transport and Relaxation Processes. Springer, 2010.

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14

Bokstein, Boris S., Mikhail I. Mendelev, and David J. Srolovitz. Thermodynamics and Kinetics in Materials Science. Oxford University Press, 2005. http://dx.doi.org/10.1093/oso/9780198528036.001.0001.

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This text presents a concise and thorough introduction to the main concepts and practical applications of thermodynamics and kinetics in materials science. It is designed with two types of uses in mind: firstly for one or two semester university course for mid- to - upper level undergraduate or first year graduate students in a materials-science-oriented discipline and secondly for individuals who want to study the materials on their own. The following major topics are discussed: basic laws of classical and irreversible thermodynamics, phase equilibria, theory of solutions, chemical reaction thermodynamics and kinetics, surface phenomena, stressed systems, diffusion and statistical thermodynamics. A large number of example problems with detailed solutions are included as well as accompanying computer-based self-tests, consisting of over 400 questions and 2000 answers with hints for students. Computer-based laboratories are provided, in which a laboratory problem is posed and the experiment described. The student can "perform" the experiments and change the laboratory conditions to obtain the data required for meeting the laboratory objective. Each "laboratory" is augmented with background material to aid analysis of the experimental results.

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15

Morawetz, Klaus. Interacting Systems far from Equilibrium. Oxford University Press, 2018. http://dx.doi.org/10.1093/oso/9780198797241.001.0001.

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In quantum statistics based on many-body Green’s functions, the effective medium is represented by the selfenergy. This book aims to discuss the selfenergy from this point of view. The knowledge of the exact selfenergy is equivalent to the knowledge of the exact correlation function from which one can evaluate any single-particle observable. Complete interpretations of the selfenergy are as rich as the properties of the many-body systems. It will be shown that classical features are helpful to understand the selfenergy, but in many cases we have to include additional aspects describing the internal dynamics of the interaction. The inductive presentation introduces the concept of Ludwig Boltzmann to describe correlations by the scattering of many particles from elementary principles up to refined approximations of many-body quantum systems. The ultimate goal is to contribute to the understanding of the time-dependent formation of correlations. Within this book an up-to-date most simple formalism of nonequilibrium Green’s functions is presented to cover different applications ranging from solid state physics (impurity scattering, semiconductor, superconductivity, Bose–Einstein condensation, spin-orbit coupled systems), plasma physics (screening, transport in magnetic fields), cold atoms in optical lattices up to nuclear reactions (heavy-ion collisions). Both possibilities are provided, to learn the quantum kinetic theory in terms of Green’s functions from the basics using experiences with phenomena, and experienced researchers can find a framework to develop and to apply the quantum many-body theory straight to versatile phenomena.

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16

A Phase Rule Approach to Critical Point Phenomena in Chemically Reacting Systems: A Dissertation. Ann Arbor, USA: ProQuest Dissertations Publishing, 2017.

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17

Садовников, Василий. Теория гетерогенного катализа. Теория хемосорбции. Publishing House Triumph, 2021. http://dx.doi.org/10.32986/978-5-40-10-01-2001.

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This monograph is a continuation of the monograph by V.V. Sadovnikov. Lateral interaction. Moscow 2006. Publishing house "Anta-Eco", 2006. ISBN 5-9730-0017-6. In this work, the foundations of the theory of heterogeneous catalysis and the theory of chemisorption are more easily formulated. The book consists of two parts, closely related to each other. These are the theoretical foundations of heterogeneous catalysis and chemisorption. In the theory of heterogeneous catalysis, an experiment is described in detail, which must be carried out in order to isolate the stages of a catalytic reaction, to find the stoichiometry of each of the stages. This experiment is based on the need to obtain the exact value of the specific surface area of the catalyst, the number of centers at which the reaction proceeds, and the output curves of each of the reaction products. The procedures for obtaining this data are described in detail. Equations are proposed and solved that allow calculating the kinetic parameters of the nonequilibrium stage and the thermodynamic parameters of the equilibrium stage. The description of the quantitative theory of chemisorption is based on the description of the motion of an atom along a crystal face. The axioms on which this mathematics should be based are formulated, the mathematical apparatus of the theory is written and the most detailed instructions on how to use it are presented. The first axiom: an atom, moving along the surface, is present only in places with minima of potential energy. The second axiom: the face of an atom is divided into cells, and the position of the atom on the surface of the face is set by one parameter: the cell number. The third axiom: the atom interacts with the surrounding material bodies only at the points of minimum potential energy. The fourth axiom: the solution of the equations is a map of the arrangement of atoms on the surface. The fifth axiom: quantitative equations are based on the concept of a statistically independent particle. The formation energies of these particles and their concentration are calculated by the developed program. The program based on these axioms allows you to simulate and calculate the interaction energies of atoms on any crystal face. The monograph is intended for students, post-graduate students and researchers studying work and working in petrochemistry and oil refining.

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