Reaction Dynamics in the Condensed Phase

Reaction Dynamics in the Condensed Phase PDF Author: Shōichi Okuyama
Publisher:
ISBN:
Category : Chemical kinetics
Languages : en
Pages : 214

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Reaction Dynamics in the Condensed Phase

Reaction Dynamics in the Condensed Phase PDF Author: Shōichi Okuyama
Publisher:
ISBN:
Category : Chemical kinetics
Languages : en
Pages : 214

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Book Description


Quantum Reaction Dynamics in the Condensed Phase

Quantum Reaction Dynamics in the Condensed Phase PDF Author: Victor Salvador Batista
Publisher:
ISBN:
Category : Excited state chemistry
Languages : en
Pages : 332

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Chemical Dynamics in Condensed Phases

Chemical Dynamics in Condensed Phases PDF Author: Abraham Nitzan
Publisher: Oxford University Press
ISBN: 0198529791
Category : Science
Languages : en
Pages : 742

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Book Description
Graduate level textbook presenting some of the most fundamental processes that underlie physical, chemical and biological phenomena in complex condensed phase systems. Includes in-depth descriptions of relevant methodologies, and provides ample introductory material for readers of different backgrounds.

Theoretical Methods in Condensed Phase Chemistry

Theoretical Methods in Condensed Phase Chemistry PDF Author: S.D. Schwartz
Publisher: Springer Science & Business Media
ISBN: 0306469499
Category : Science
Languages : en
Pages : 314

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Book Description
This book is meant to provide a window on the rapidly growing body of theoretical studies of condensed phase chemistry. A brief perusal of physical chemistry journals in the early to mid 1980’s will find a large number of theor- ical papers devoted to 3-body gas phase chemical reaction dynamics. The recent history of theoretical chemistry has seen an explosion of progress in the devel- ment of methods to study similar properties of systems with Avogadro’s number of particles. While the physical properties of condensed phase systems have long been principle targets of statistical mechanics, microscopic dynamic theories that start from detailed interaction potentials and build to first principles predictions of properties are now maturing at an extraordinary rate. The techniques in use range from classical studies of new Generalized Langevin Equations, semicl- sical studies for non-adiabatic chemical reactions in condensed phase, mixed quantum classical studies of biological systems, to fully quantum studies of m- els of condensed phase environments. These techniques have become sufficiently sophisticated, that theoretical prediction of behavior in actual condensed phase environments is now possible. and in some cases, theory is driving development in experiment. The authors and chapters in this book have been chosen to represent a wide variety in the current approaches to the theoretical chemistry of condensed phase systems. I have attempted a number of groupings of the chapters, but the - versity of the work always seems to frustrate entirely consistent grouping.

Theories of Molecular Reaction Dynamics

Theories of Molecular Reaction Dynamics PDF Author: Niels E. Henriksen
Publisher: Oxford Graduate Texts
ISBN: 0198805012
Category : Chemical reaction, Conditions and laws of
Languages : en
Pages : 458

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Book Description
This book deals with a central topic at the interface of chemistry and physics--the understanding of how the transformation of matter takes place at the atomic level. Building on the laws of physics, the book focuses on the theoretical framework for predicting the outcome of chemical reactions. The style is highly systematic with attention to basic concepts and clarity of presentation. The emphasis is on concepts and insights obtained via analytical theories rather than computational and numerical aspects. Molecular reaction dynamics is about the detailed atomic-level description of chemical reactions. Based on quantum mechanics and statistical mechanics, the dynamics of uni- and bi-molecular elementary reactions are described. The book features a comprehensive presentation of transition-state theory which plays an important role in practice, and a detailed discussion of basic theories of reaction dynamics in condensed phases. Examples and end-of-chapter problems are included in order to illustrate the theory and its connection to chemical problems. The second edition includes updated descriptions of adiabatic and non-adiabatic electron-nuclear dynamics, an expanded discussion of classical two-body models of chemical reactions, including the Langevin model, additional material on quantum tunnelling and its implementation in Transition-State Theory, and a more thorough description of the Born and Onsager models for solvation.

Reaction Dynamics in Clusters and Condensed Phases

Reaction Dynamics in Clusters and Condensed Phases PDF Author: Joshua Jortner
Publisher: Springer Science & Business Media
ISBN: 9401107866
Category : Science
Languages : en
Pages : 562

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Book Description
The Twenty Sixth Jerusalem Symposium reflected the high standards of these distinguished scientific meetings, which convene once a year at the Israel Academy of Sciences and Humanities in Jerusalem to discuss a specific topic in the broad area of quantum chemistry and biochemistry. The topic at this year's Jerusalem Symposium was reaction dynamics in clusters and condensed phases, which constitutes a truly interdisciplinary subject of central interest in the areas of chemical dynamics, kinetics, photochemistry and condensed matter chemical physics. The main theme of the Symposium was built around the exploration of the interrelationship between the dynamics in large finite clusters and in infinite bulk systems. The main issues addressed microscopic and macroscopic sol vation phenomena, cluster and bulk spectroscopy, photodissociation and vibrational predissociation, cage effects, interphase dynamics, reaction dynamics and energy transfer in clusters, dense fluids, liquids, solids and biophysical systems. The interdisciplinary nature of this research area was deliberated by intensive and extensive interactions between modern theory and advanced experimental methods. This volume provides a record of the invited lectures at the Symposium.

Molecular Reaction Dynamics

Molecular Reaction Dynamics PDF Author: Raphael D. Levine
Publisher: Cambridge University Press
ISBN: 9781139442879
Category : Technology & Engineering
Languages : en
Pages : 574

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Book Description
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.

Theories of Molecular Reaction Dynamics

Theories of Molecular Reaction Dynamics PDF Author: Niels E. Henriksen
Publisher: Oxford University Press, USA
ISBN: 0199203865
Category : Science
Languages : en
Pages : 391

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Book Description
This book deals with a central topic at the interface of chemistry and physics - the understanding of how the transformation of matter takes place at the atomic level. Building on the laws of physics, the book focuses on the theoretical framework for predicting the outcome of chemical reactions. The style is highly systematic with attention to basic concepts and clarity of presentation. Molecular reaction dynamics is about the detailed atomic-level description of chemical reactions. Based on quantum mechanics and statistical mechanics or, as an approximation, classical mechanics, the dynamics of uni- and bi-molecular elementary reactions are described. The book features a detailed presentation of transition-state theory which plays an important role in practice, and a comprehensive discussion of basic theories of reaction dynamics in condensed phases. Examples and end-of-chapter problems are included in order to illustrate the theory and its connection to chemical problems.

Modeling Condensed Phase Reaction Dynamics

Modeling Condensed Phase Reaction Dynamics PDF Author: Hakan Gunaydin
Publisher:
ISBN:
Category :
Languages : en
Pages : 386

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Book Description


Internal Energy in Condensed Phase Reaction Dynamics

Internal Energy in Condensed Phase Reaction Dynamics PDF Author:
Publisher:
ISBN:
Category :
Languages : en
Pages : 2

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Book Description
This grant is a DURIP funded project that provided a portion of the funds to construct a laboratory for studying the ultrafast dynamics of molecules in condensed phases. The heart of the experimental apparatus is a pulsed Ti:sapphire laser producing 100 fs pulses. The goal of the work was to establish the laboratory and characterize the laser pulses for use in the experimental studies. We have identified and brought to Madison two crucial components of this effort: a state of the art femtosecond laser system, and an experienced and able post-doctoral associate to make the experiments a reality. During the first several months of this grant, we identified the optimum system, a Tl:sapphire oscillator and regenerative amplifier system from Clark Instruments. We purchased the system, extensively remodelled a laboratory to accommodate it and installed it in August. We have completed the data acquisition system while characterizing the laser and optimizing its performance. We have built a frequency resolved optical gating system and measured the bandwidth and duration of the pulses from the Tl:sapphire laser. p2.