Tutorials in Molecular Reaction Dynamics
Tutorials in Molecular Reaction Dynamics

Author: Mark Brouard

Publisher: Royal Society of Chemistry

Published: 2015-11-09

Total Pages: 507

ISBN-13: 178262614X

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The focus of this excellent textbook is the topic of molecular reaction dynamics. The chapters are all written by internationally recognised researchers and, from the outset, the contributors are writing with the young scientist in mind. The easy to use, stand-alone, chapters make it of value to students, teachers, and researchers alike. Subjects covered range from the more traditional topics, such as potential energy surfaces, to more advanced and rapidly developing areas, such as femtochemistry and coherent control. The coverage of reaction dynamics is very broad, so many students studying chemical physics will find elements of this text interesting and useful. Tutorials in Molecular Reaction Dynamics includes extensive references to more advanced texts and research papers, and a series of 'Study Boxes' help readers grapple with the more difficult concepts. Each chapter is thoroughly cross-referenced, helping the reader to link concepts from different branches of the subject. Worked problems are included, and each chapter concludes with a selection of problems designed to test understanding of the subjects covered. Supplementary reading material, and worked solutions to the problems, are contained on a secure website.

Molecular Reaction Dynamics
Molecular Reaction Dynamics

Author: Raphael D. Levine

Publisher: Cambridge University Press

Published: 2009-06-04

Total Pages: 574

ISBN-13: 9781139442879

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Molecular reaction dynamics is the study of chemical and physical transformations of matter at the molecular level. The understanding of how chemical reactions occur and how to control them is fundamental to chemists and interdisciplinary areas such as materials and nanoscience, rational drug design, environmental and astrochemistry. This book provides a thorough foundation to this area. The first half is introductory, detailing experimental techniques for initiating and probing reaction dynamics and the essential insights that have been gained. The second part explores key areas including photoselective chemistry, stereochemistry, chemical reactions in real time and chemical reaction dynamics in solutions and interfaces. Typical of the new challenges are molecular machines, enzyme action and molecular control. With problem sets included, this book is suitable for advanced undergraduate and graduate students, as well as being supplementary to chemical kinetics, physical chemistry, biophysics and materials science courses, and as a primer for practising scientists.

Chemical Kinetics and Reaction Dynamics
Chemical Kinetics and Reaction Dynamics

Author: Santosh K. Upadhyay

Publisher: Springer Science & Business Media

Published: 2007-04-29

Total Pages: 256

ISBN-13: 1402045476

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Chemical Kinetics and Reaction Dynamics brings together the major facts and theories relating to the rates with which chemical reactions occur from both the macroscopic and microscopic point of view. This book helps the reader achieve a thorough understanding of the principles of chemical kinetics and includes: Detailed stereochemical discussions of reaction steps Classical theory based calculations of state-to-state rate constants A collection of matters on kinetics of various special reactions such as micellar catalysis, phase transfer catalysis, inhibition processes, oscillatory reactions, solid-state reactions, and polymerization reactions at a single source. The growth of the chemical industry greatly depends on the application of chemical kinetics, catalysts and catalytic processes. This volume is therefore an invaluable resource for all academics, industrial researchers and students interested in kinetics, molecular reaction dynamics, and the mechanisms of chemical reactions.

An Introduction to Chemical Kinetics
An Introduction to Chemical Kinetics

Author: Claire Vallance

Publisher: Morgan & Claypool Publishers

Published: 2017-09-28

Total Pages: 101

ISBN-13: 1681746670

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The book is a short primer on chemical reaction rates based on a six-lecture first-year undergraduate course taught by the author at the University of Oxford. The book explores the various factors that determine how fast or slowly a chemical reaction proceeds and describes a variety of experimental methods for measuring reaction rates. The link between the reaction rate and the sequence of steps that makes up the reaction mechanism is also investigated. Chemical reaction rates is a core topic in all undergraduate chemistry courses.

Astrochemistry: From The Big Bang To The Present Day
Astrochemistry: From The Big Bang To The Present Day

Author: Claire Vallance

Publisher: World Scientific Publishing Company

Published: 2017-02-22

Total Pages: 226

ISBN-13: 1786340402

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'This book could appeal to astronomers interested in interstellar and circumstellar matter who would like to know more about the processes in them from a chemist's perspective in a modern textbook. Overall, I found this book very informative and clearly written …'The Observatory MagazineThe rapidly growing field of astrochemistry focuses on the chemistry occurring in stars, planets, and the interstellar medium, bringing together elements of chemistry, physics, astrophysics, and biology. Astrochemistry describes the chemical history of the Universe, our solar system, and our planet. It explores in some detail the 'alien' chemistry occurring in interstellar gas clouds, the regions where stars and planets are formed, and also looks at the theoretical and experimental methods that allow us to carry out Earth-based studies of astrochemistry.The evolution of the Universe and the complex chemistry occurring both in interstellar space and in the planetary systems that form in these regions is explained primarily in terms of basic principles of physical chemistry. While there is plenty to interest the general reader, this book is aimed at intermediate to advanced undergraduates of chemistry and astrochemistry, highlighting many different aspects of physical chemistry and demonstrating their relevance to the world we live in.This book was written in conjunction with Atmospheric Chemistry: From the Surface to the Stratosphere, Grant Ritchie (2017) World Scientific Publishing.

Studies of Photoinduced Molecular Dynamics Using a Fast Imaging Sensor
Studies of Photoinduced Molecular Dynamics Using a Fast Imaging Sensor

Author: Craig S. Slater

Publisher: Springer

Published: 2015-10-15

Total Pages: 194

ISBN-13: 3319245171

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The work presented in this thesis involves a number of sophisticated experiments highlighting novel applications of the Pixel Imaging Mass Spectrometry (PImMS) camera in the field of photoinduced molecular dynamics. This approach represents the union of a new enabling technology (a multiple memory register, CMOS-based pixel detector) with several modern chemical physics approaches and represents a significant leap forward in capabilities. Applications demonstrated include three-dimensional imaging of photofragment Newton spheres, simultaneous electron-ion detection using a single sensor, and ion-ion velocity correlation measurements that open the door to novel covariance imaging experiments. When combined with Coulomb explosion imaging, such an approach is demonstrated to allow the measurement of molecular structure and motion on a femtosecond timescale. This is illustrated through the controlled photoexcitation of torsional motion in biphenyl molecules and the subsequent real-time measurement of the torsional angle.

An Introduction to the Gas Phase
An Introduction to the Gas Phase

Author: Claire Vallance

Publisher: Morgan & Claypool Publishers

Published: 2017-12-08

Total Pages: 57

ISBN-13: 1681746921

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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.

Theory of Molecular Collisions
Theory of Molecular Collisions

Author: Gabriel G. Balint-Kurti

Publisher: Royal Society of Chemistry

Published: 2015-07-03

Total Pages: 294

ISBN-13: 1849738300

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Almost 100 years have passed since Trautz and Lewis put forward their collision theory of molecular processes. Today, knowledge of molecular collisions forms a key part of predicting and understanding chemical reactions. This book begins by setting out the classical and quantum theories of atom-atom collisions. Experimentally observable aspects of the scattering processes; their relationship to reaction rate constants and the experimental methods used to determine them are described. The quantum mechanical theory of reactive scattering is presented and related to experimental observables. The role of lasers in the measurement and analysis of reactive molecular collisions is also discussed. Written with postgraduates and newcomers to the field in mind, mathematics is kept to a minimum, and readers are guided to appendices and further reading to gain a deeper understanding of the mathematics involved.

Tools For Chemical Product Design
Tools For Chemical Product Design

Author: Mariano Martín Martín

Publisher: Elsevier

Published: 2016-09-19

Total Pages: 702

ISBN-13: 0444636846

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Tools for Chemical Product Design: From Consumer Products to Biomedicine describes the challenges involved in systematic product design across a variety of industries and provides a comprehensive overview of mathematical tools aimed at the design of chemical products, from molecular design to customer products. Chemical product design has become increasingly important over the past decade and includes a wide range of sectors including gasoline additives and blends in the petroleum industry, active ingredients and excipients in the pharmaceutical industry, and a variety of consumer products and specialty chemicals. Traditionally, such products have been designed through trial and error methods, which not only are time-consuming, but more importantly only provide limited knowledge that can be translated into next generation products. - Features an impressive collection of contributions from leading researchers in the field - Presents the latest tools available across a variety of industries - Describes the challenges involved in systematic product design as well as the latest methods for solving such problems - Covers a wide range of sectors including gasoline additives and blends in the petroleum industry, active ingredients and excipients in the pharmaceutical industry, and a variety of consumer products and specialty chemicals

Cold Chemistry
Cold Chemistry

Author: Olivier Dulieu

Publisher: Royal Society of Chemistry

Published: 2017-12-12

Total Pages: 692

ISBN-13: 1782625976

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Explores the theoretical and experimental aspects of cold and ultracold molecular collisions, for students and researchers in theoretical chemistry and chemical reaction/molecular dynamics.