In recent years a number of non-linear Raman spectroscopic techniques have been substantially developed and are now proving to be powerful methods for the solution of many problems not only in spectroscopy but also in chemistry, physics and biology. These techniques include hyper Rayleigh and hyper Raman spectroscopy, coherent anti-Stokes Raman Spectroscopy (CARS), Raman Gain and In verse Raman Spectroscopy, Photoacoustic Raman Spectroscopy (PARS) and the Raman Induced Kerr Effect (RIKE). Hyper Raman spectro scopy although experimentally difficult is valuable for investi gating transitions which are not active in the infrared or in the linear Raman effect; and the other non-linear Raman effects can provide signal strength and resolution which are orders of magni tude higher than those obtainable with linear Raman spectroscopy. The thirty chapters in this book will form the basis of lectures presented at the NATO Advanced Study Institute in Bad Windsheim, F. R. Germany from August 23 - September 3, 1982."

The study of surfaces has experienced dramatic growth over the past decade. Now, the editors of the internationally celebrated series Advances in Chemical Physics have brought together in this self-contained, special topic volume contributions from leading researchers in the field treating some of the most crucial aspects of the experimental and theoretical study of surfaces. This work delves into such core issues as:

• Kinetics and dynamics of hydrogen adsorption on silicon surfaces.
• Potential energy surfaces of transition- metal-catalyzed chemical reactions.
• High-resolution helium atom scattering as a proof of surface vibrations.
• Ordering and phase transitions in adsorbed monolayers of diatomic molecules.
• The influence of dimensionality on static and dynamic properties of a system.
• New applications to fields as varied as catalysts and the passage of molecules through membranes.

This valuable resource provides important insights into the current state of knowledge about surface properties. Prigogine and Rice's latest work will stimulate the imagination and motivate the exploration of other aspects of this fascinating subject.

Key features: Supported by the latest research and based on the state-of-the-art computational methods in high-accuracy computational spectroscopy of molecules Authored by an authority in the field Accessible to both experts and non-experts working in the area of computational and experimental spectroscopy, in addition to graduate students

The first volume in this series appeared in 1977, the second in 1980. From these volumes and the present one, some research trends in chemical communication can be perceived. In the 1977 volume, studies on 13 animal taxa were reported. In the present volume, the number is 25. This taxonomie diversi fication of research since the first volume of this series demon strates the wide variety of ecological adaptions, although no new general principles of chemical communication have ernerged. Further more, divergences in chemical comrnunication below the species level have become more apparent. In general, more sophisticated observa tions and techniques have led to greater awareness of the com plexities in chemical communication. As such awareness has also developed in the field of insect chemical communication, there has been a corresponding increase in the identification of the chemical compounds involved. However, in the vertebrates, no such correlation exists; in the present volume, conclusive chemical identifications of semiochemicals are remarkable by their paucity.

We have shown that simple power-law dynamics is expected for flexible fractal objects. Although the predicted behavior is well established for linear polymers, the situationm is considerably more complex for colloidal aggregates. In the latter case, the observed K-dependence of (r) can be explained either in terms of non-asymptotic hydrodynamics or in terms of weak power-law polydispersity. In the case of powders (alumina, in particular) apparent fractal behavior seen in static scattering is not found in the dynamics. ID. W. Schaefer, J. E. Martin, P. Wiitzius, and D. S. Cannell, Phys. Rev. Lett. 52,2371 (1984). 2 J. E. Martin and D. W. Schaefer, Phys. Rev. Lett. 5:1,2457 (1984). 3 D. W. Schaefer and C. C. Han in Dynamic Light Scattering, R. Pecora ed, Plenum, NY, 1985) p. 181. 4 P. Sen, this book. S J. E. Martin and B. J. Ackerson, Phys. Rev. A :11, 1180 (1985). 6 J. E. Martin, to be published. 7 D. A. Weitz, J. S. Huang, M. Y. Lin and J. Sung, Phys. Rev. Lett. 53,1657 (1984) . 8 J. E. Martin, D. W. Schaefer and A. J. Hurd, to be published; D. W. Schaefer, K. D. Keefer, J. E. Martin, and A. J. Hurd, in Physics of Finely Divided Matter, M. Daoud, Ed., Springer Verlag, NY, 1985. 9 D. W. Schaefer and A. J. Hurd, to be published. lOJ. E. Martin, J. Appl. Cryst. (to be published).

The use of numerical grid methods to solve the Schrodinger equation has rapidly evolved in the past decade.The early attempts to demonstrate the computational viability of grid methods have been largely superseded by applications to specific problems and deeper research into more sophisticated quadrature schemes. Underpinning this research, of course, is the belief that the generic nature of grid methods can enjoy a symbiotic development with advances in computer technology, harnessing this technology in an effective manner. The contributions to this proceedings demonstrate these points in full: several appli cations displayed creative use and extension of existing grid methodology; other research concentrated on the development of new quadrature schemes or mixed numerical meth ods. The research represented ranges from highly specific spectral simulations of van der Waals complexs to general schemes for reactive scattering. The novelty of grid methods in Density Functional Theory calculations should also be highlighted since it represents an alternative to standard basis set expansion techniques and might offer distinct advantages to the standard techniques. A deliberate attempt was made to present research material with more motivational and background discussion than is typical of research publications. It is hoped that these contributed proceedings will be useful to students and researchers outside the field to have a rapid and complete introduction to many of the exciting uses of grid methodology in atomic and molecular physics. Special thanks are due to the NATO Science Committee for its generous support of the activities of this workshop."

Conjugated polymers have important technological applications, including solar cells and light emitting devices. They are also active components in many important biological processes. In recent years there have been significant advances in our understanding of these systems, owing to both improved experimental measurements and the development of advanced computational techniques. The aim of this book is to describe and explain the electronic and optical properties of conjugated polymers. It focuses on the three key roles of electron-electron interactions, electron-nuclear coupling, and disorder in determining the character of the electronic states, and it relates these properties to experimental observations in real systems. A number of important optical and electronic processes in conjugated polymers are also described. The second edition has a more extended discussion of excitons in conjugated polymers. There is also a new chapter on the static and dynamical localization of excitons.

Taking an individual approach, this book focuses on the concepts underlying chemical physics. It presents the essence of a connected theory rather than mere explanations of apparently unrelated facts, helping readers to understand chemical phenomena in terms of the most fundamental laws of physics.

Acids and bases are ubiquitous in chemistry. Our understanding of them, however, is dominated by their behaviour in water. Transfer to non-aqueous solvents leads to profound changes in acid-base strengths and to the rates and equilibria of many processes: for example, synthetic reactions involving acids, bases and nucleophiles; isolation of pharmaceutical actives through salt formation; formation of zwitter- ions in amino acids; and chromatographic separation of substrates. This book seeks to enhance our understanding of acids and bases by reviewing and analysing their behaviour in non-aqueous solvents. The behaviour is related where possible to that in water, but correlations and contrasts between solvents are also presented. Fundamental background material is provided in the initial chapters: quantitative aspects of acid-base equilibria, including definitions and relationships between solution pH and species distribution; the influence of molecular structure on acid strengths; and acidity in aqueous solution. Solvent properties are reviewed, along with the magnitude of the interaction energies of solvent molecules with (especially) ions; the ability of solvents to participate in hydrogen bonding and to accept or donate electron pairs is seen to be crucial. Experimental methods for determining dissociation constants are described in detail. In the remaining chapters, dissociation constants of a wide range of acids in three distinct classes of solvents are discussed: protic solvents, such as alcohols, which are strong hydrogen-bond donors; basic, polar aprotic solvents, such as dimethylformamide; and low-basicity and low polarity solvents, such as acetonitrile and tetrahydrofuran. Dissociation constants of individual acids vary over more than 20 orders of magnitude among the solvents, and there is a strong differentiation between the response of neutral and charged acids to solvent change. Ion-pairing and hydrogen-bonding equilibria, such as between phenol and phenoxide ions, play an increasingly important role as the solvent polarity decreases, and their influence on acid-base equilibria and salt formation is described.

This book is a reissue of a classic Oxford text, and provides a comprehensive treatment of electron paramagnetic resonance of ions of the transition groups. The emphasis is on basic principles, with numerous references to publications containing further experimental results and more detailed developments of the theory. An introductory survey gives a general understanding, and a general survey presents such topics as the classical and quantum resonance equations, the spin-Hamiltonian, Endor, spin-spin and spin-lattice interactions, together with an outline of the known behaviour of ions of each of the five transition groups, at the experimentalist's level. Finally a theoretical survey, using group theory and symmetry properties, discusses the fundamentals of the theory of paramagnetism.

This is a textbook on the theory and calculation of molecular electromagnetic and spectroscopic properties designed for a one-semester course with lectures and exercise classes. The idea of the book is to provide thorough background knowledge for the calculation of electromagnetic and spectroscopic properties of molecules with modern quantum chemical software packages.
The book covers the derivation of the molecular Hamiltonian in the presence of electromagnetic fields, and of time-independent and time-dependent perturbation theory in the form of response theory. It defines many molecular properties and spectral parameters and gives an introduction to modern computational chemistry methods.

Bio-nanocomposites combine the enhanced properties of commercial polymer nanocomposites with the low environmental impact of biodegradable material, making them a topic of great current interest. Because of their tremendous role in reducing dependency on commercial non-biodegradable polymers, and their environmentally-friendly nature, bio-nanocomposites need to be studied in greater detail. In this book, recent advancements in their development are brought together in a single text, to provide researchers with a thorough insight into the various systems, and to open up future perspectives. Although the commercial applications of these bio-nanocomposites are in their infancy, these materials have a huge commercial potential. In setting out the next generation of advances in nanocomposite technology, this book opens the way for further developments in the field.
Describing the subject as a whole, from a basic introduction to the more specific systems and advancements, this book can be used both as a professional reference and for teaching purposes.

Brownian motion - the incessant motion of small particles suspended in a fluid - is an important topic in statistical physics and physical chemistry. This book studies its origin in molecular scale fluctuations, its description in terms of random process theory and also in terms of statistical mechanics. A number of new applications of these descriptions to physical and chemical processes, as well as statistical mechanical derivations and the mathematical background are discussed in detail. Graduate students, lecturers, and researchers in statistical physics and physical chemistry will find this an interesting and useful reference work.

Microfluidics deals with fluids flowing in miniaturized systems. It is a young discipline, which is expected to substantially expand over the next few years, stimulated by the considerable development of applications in the pharmaceutical, biomedical and chemical engineering domains.
The book is an introduction to this discipline. In the first chapter, it presents a short historical background and discusses the main perspectives of the domain, at economical and scientific levels. Then the physics of miniaturization and the fluid mechanics of microflows are discussed. In the following three chapters, dispersion, electrical and thermal phenomena in miniaturized devices are presented. A brief introduction to microfabrication techniques is given in chapter six and the book concludes by providing a few examples of microfludic systems.
The book is written in a simple, direct, pedagogical way. It emphasizes concepts and understanding, rather than technical detail. It offers a cross-disciplinary view of the field embracing biological, chemical, physical and engineering perspectives. By using the book, the reader will have concepts, methods and data to grasp situation, which typically arise in mircofludic systems.

This book provides a critical review of the equilibrium elastic properties of rubber, together with the kinetic-theory background. It is suitable for the non-specialist and the emphasis is on the physical reality embodied in the mathematical formulations. Polymer science had developed greatly since the second edition of this text in 1958, and the two main advances - the refinements of the network theory and associated thermodynamic analysis, and the development of the phenomenological or non-molecular approach to the subject - are both reflected in the structure of this third edition.

Leading research, perspectives, and analysis of dynamical systems and irreversibility

Edited by Nobel Prize winner Ilya Prigogine and renowned authority Stuart A. Rice, the Advances in Chemical Physics series provides a forum for critical, authoritative evaluations in every area of the discipline. In a format that encourages the expression of individual points of view, experts in the field present comprehensive analyses of subjects of interest. Volume 122 collects papers from the XXI Solvay Conference on Physics, dedicated to the exploration of "Dynamical Systems and Irreversibility." Ioannis Antoniou, Deputy Director of the International Solvay Institutes for Physics and Chemistry, edits and assembles this cutting-edge research, including articles such as "Non-Markovian Effects in the Standard Map," "Harmonic Analysis of Unstable Systems," "Age and Age Fluctuations in an Unstable Quantum System," and discussion of many more subjects. Advances in Chemical Physics remains the premier venue for presentations of new findings in its field.

Specialist Periodical Reports provide systematic and detailed review coverage of progress in the major areas of chemical research. Written by experts in their specialist fields the series creates a unique service for the active research chemist, supplying regular critical in-depth accounts of progress in particular areas of chemistry. For over 80 years the Royal Society of Chemistry and its predecessor, the Chemical Society, have been publishing reports charting developments in chemistry, which originally took the form of Annual Reports. However, by 1967 the whole spectrum of chemistry could no longer be contained within one volume and the series Specialist Periodical Reports was born. The Annual Reports themselves still existed but were divided into two, and subsequently three, volumes covering Inorganic, Organic and Physical Chemistry. For more general coverage of the highlights in chemistry they remain a 'must'. Since that time the SPR series has altered according to the fluctuating degree of activity in various fields of chemistry. Some titles have remained unchanged, while others have altered their emphasis along with their titles; some have been combined under a new name whereas others have had to be discontinued.

This comprehensive and systematic text provides the polymer scientist and technologist with a firm grounding in the principles underlying the wide applications of block copolymers. The first text of its kind for over ten years, this informative book is essential to the polymer chemistry, physics and materials science researcher in industry and academia, and postgraduates in related fields.

This book provides a comprehensive survey of modern molecular astrophysics. It includes an introduction to molecular spectroscopy and then addresses the main areas of current molecular astrophysics, including galaxy formation, star forming regions, mass loss from young as well as highly evolved stars and supernovae, starburst galaxies plus the tori and discs near the central engines of active galactic nuclei. All chapters have been written by invited authors who are acknowledged experts in their fields. The thorough editorial process has ensured a uniformly high standard of exposition and a coherent style. The book is unique in giving a detailed view of its wide-ranging subject. It will provide the standard introduction for research students in molecular astrophysics. The book will be read by research astronomers and astrophysicists who wish to broaden the basis of their knowledge or are moving their activities into this burgeoning field. It will enable chemists to learn the astrophysics most related to chemistry as well as instruct physicists about the molecular processes most important in astronomy.

A stand-alone, monograph present results on mechanochemical synthesis of nanostructured composite materials on the base of inorganic and organic components The book summarizes and systematizes the results of a fundamentally new complex approach to the creation of composite polymer-inorganic systems by mechanochemical treatment, both as a result of the traditional approach with the use of dynamic mills (mechanical reactors) and ultrasonic action on powder mixtures In addition, the book will present a chapter that will focus on the method of mechanochemical preparation of materials for high-energy systems, which are the most promising, since it allows the most productive management of the formation of new structural compositions that increase the energy intensity of the system.

Prigogine and Rice's highly acclaimed series, Advances in Chemical Physics, provides a forum for critical, authoritative reviews of current topics in every area of chemical physics. Edited by J.K. Vij, this volume focuses on recent advances in liquid crystals with significant, up-to-date chapters authored by internationally recognized researchers in the field.

Electroinduced Drift of Neutral Charge Clusters in Salt Solutions presents studies of the processes accompanying the effect of periodic electric and magnetic fields on salt solutions in polar dielectric liquids. The authors explain phenomena from a physical point of view, without theoretical constructions and mathematical calculations. This is done in order to make the book accessible to a wide audience and to help the reader navigate in a multilateral topic that is touched upon when studying processes that occur in liquid media under the external influence of an electromagnetic nature. Additional Features: Explores the phenomenon of selective drift of solvated ions in polar dielectric liquids Applies general principles of electricity and magnetism to describe experimental results Demonstrates how small perturbations of the equilibrium distribution determine not the corrections to the effects but the effects themselves Approaches nonequilibrium molecular physics as a science of physical and chemical processes This book will be useful to specialists, engineers and graduate students, especially those recording and transmitting information in liquid media.

This book is devoted to the problems of oxidation chemical reactions and addresses bimodal reaction sequences. Chemical reactions of oxidation, occurring under certain conditions and in multicomponent systems are complex processes. The process of the oxidation essentially changes in the presence and contact of the solid substances with reactants. The role of solid substances and the appearance of this phenomenon in oxidation reaction are discussed. The reader will understand the "driving forces" of this phenomenon and apply it in practice. Written for chemists, physicists, biologists and engineers working in the domain of oxidation reactions. Key Selling Features: Covers the historical background, modern state of the art, and perspectives in investigations of the coupling between heterogeneous and homogeneous reactions Discusses the feasible pathways of the coupling of heterogeneous and homogeneous reactions in oxidation in man-made and natural chemical systems Addresses the abundance, peculiarities and mechanisms of the bimodal reaction sequences in oxidation with dioxygen in recent decades Discusses the existence of the bimodal reaction sequences in chemical systems investigations in atmospheric chemistry and heterogeneous photocatalysis Presented in a simple concise style, accessible for both specialists and non-specialists

While modern computational methods can provide us with the wave function of a molecule in numerical form, most computer programs lack the sophisticated tools needed to extract chemical concepts from these wave functions. Saving researchers vast time and potential confusion, this volume collects and organizes those validated tools currently scattered throughout the literature and details their application. It provides immediate access for those needing to calculate such critical factors as bond order and valence indices, and atomic and diatomic contributions to molecular energy. Supporting material is available for download from the authors' continually updated website.

Quantum mechanics is a general theory of the motions, structures, properties, and behaviors of particles of atomic and subatomic dimensions. While quantum mechanics was created in the first third of the twentieth century by a handful of theoretical physicists working on a limited number of problems, it has further developed and is now applied by a great number of people working on a vast range of problems in wide areas of science and technology. Basic Molecular Quantum Mechanics introduces quantum mechanics by covering the fundamentals of quantum mechanics and some of its most important chemical applications: vibrational and rotational spectroscopy and electronic structure of atoms and molecules. Thoughtfully organized, the author builds up quantum mechanics systematically with each chapter preparing the student for the more advanced chapters and complex applications. Additional features include the following: This book presents rigorous and precise explanations of quantum mechanics and mathematical proofs. It contains qualitative discussions of key concepts with mathematics presented in the appendices. It provides problems and solutions at the end of each chapter to encourage understanding and application. This book is carefully written to emphasize its applications to chemistry and is a valuable resource for advanced undergraduates and beginning graduate students specializing in chemistry, in related fields such as chemical engineering and materials science, and in some areas of biology.