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.

A valuable learning tool for students and an indispensable resource for professional scientists and engineers

Several outstanding features make this book a superior introduction to modern statistical mechanics: It is the only intermediate-level text offering comprehensive coverage of both basic statistical mechanics and modern topics such as molecular dynamic methods, renormalization theory, chaos, polymer chain folding, oscillating chemical reactions, and cellular automata. It is also the only text written at this level to address both equilibrium and nonequilibrium statistical mechanics. Finally, students and professionals alike will appreciate such aids to comprehension as detailed derivations for most equations, more than 100 chapter-end exercises, and 15 computer programs written in FORTRAN that illustrate many of the concepts covered in the text.

Statistical Mechanics begins with a refresher course in the essentials of modern statistical mechanics which, on its own, can serve as a handy pocket guide to basic definitions and formulas. Part II is devoted to equilibrium statistical mechanics. Readers will find in-depth coverage of phase transitions, critical phenomena, liquids, molecular dynamics, Monte Carlo techniques, polymers, and more. Part III focuses on nonequilibrium statistical mechanics and progresses in a logical manner from near-equilibrium systems, for which linear responses can be used, to far-from-equilibrium systems requiring nonlinear differential equations.

Nanostructured oxide materials - ultra-thin films, nanoparticles and other nanometer-scale objects - play prominent roles in many aspects of our every-day life, in nature and in technological applications, among which is the all-oxide electronics of tomorrow. Due to their reduced dimensions and dimensionality, they strongly interact with their environment: gaseous atmosphere, water or support. Their novel physical and chemical properties are the subject of this book, from both a fundamental and an applied perspective. Oxide Thin Films and Nanostructures reviews and illustrates the various methodologies for their growth, fabrication, experimental and theoretical characterization. The role of key parameters such as film thickness, nanoparticle size and support interactions in driving their fundamental properties is underlined. At the ultimate thickness limit, two-dimensional oxide materials are generated, whose functionalities and potential applications are described. The emerging field of cation mixing is mentioned, which opens new avenues for engineering many oxide properties, as witnessed by natural oxide nanomaterials such as clay minerals, which, beyond their role at the Earth's surface, are now widely used in a whole range of human activities. Oxide nanomaterials are involved in many interdisciplinary fields of advanced nanotechnologies. Catalysis, photocatalysis, solar energy materials, fuel cells, corrosion protection, and biotechnological applications are amongst the areas where they are making an impact. The book outlines prototypical examples. A cautious glimpse into future developments of scientific activity is finally ventured to round off the presentation.

This series provides the chemical physics field with a forum for critical, authoritative evaluations of advances in every area of the discipline. "Volume 145" in the series continues to report recent advances with significant, up-to-date chapters by internationally recognized researchers.

Low Energy Ion - Surface Interactions Edited by J. Wayne Rabalais, University of Houston, Texas, USA Recent advances in experimental techniques and theoretical methodologies mean that increasingly detailed and sophisticated studies of state - or energy - selected molecular ions can now be performed. Each volume in this series will be dedicated to reviewing a specific topic, emphasizing new experimental and theoretical developments in the study of ions. This volume details the current understanding of Low Energy Ion - Surface Interactions, along with some of the novel applications. Each of the ten chapters is authored by active researchers in the field who are at the forefront of research in their particular areas. This up-to-date compilation, detailing developments occurring within the last five years, will be particularly useful to researchers and teachers involved with Low Energy Ion - Surface Interactions.

The purpose of this book is to explain the basic physical principles underlying the use of supercritical fluids. Excessive detail is avoided and experimental examples are used sparingly to illustrate the principles, so that the basic principles are clear. Some of the topics are not presently covered in other books or in the literature. The first half of the book covers the very basic topics and in the second half these are applied to separation methods and chemical reactions.

Magnetic resonance is a field that has expanded to a range of disciplines and applications, both in basic research and in its applications, and polarized targets have played an important role in this growth. This volume covers the range of disciplines required for understanding polarized targets, focusing in particular on the theoretical and technical developments made in dynamic nuclear polarization (DNP), NMR polarization measurement, high-power refrigeration, and magnet technology. Beyond particle and nuclear physics experiments, dynamically polarized nuclei have been used for experiments involving structural studies of biomolecules by neutron scattering and by NMR spectroscopy. Emerging applications in MRI are also benefiting from the sensitivity and contrast enhancements made possible by DNP or other hyperpolarization techniques. Topics are introduced theoretically using language and terminology suitable for scientists and advanced students from a range of disciplines, making this an accessible resource to this interdisciplinary field.

This book provides a comprehensive study of the symmetry and geometry of crystals and molecules, starting from first principles. The pre-knowledge assumed is mathematics and physical science to about A-level; additional mathematical topics are discussed in appendices. It is copiously illustrated, including many stereoviews, with instructions both for stereoviewing and for constructing a stereoviewer. Problems for each chapter are provided, with fully worked tutorial solutions. A suite of associated computer programs has been devised and placed on-line, for assisting both the study of the text and the solutions of the problems. The programs are easily executed, and instructions are provided in the text and on the monitor screen. The applicability of symmetry in everyday life as well as in science is stressed. Point groups and space groups are first discussed and derived in a semi-analytical manner, and later by use of group theory. The basic principles of group theory are discussed, together with applications to symmetry, chemical bonding and aspects of vibrations of molecules and crystals. The book is addressed to those studying the physical sciences and meeting the subject for the first time, and it brings the reader to a level of appreciation for the definitive works produced by the International Union of Crystallography, such as the International Tables for X-ray Crystallography, Vol 1 (1965) and the International Tables for Crystallography, Vol A (2006).

The theory of intermolecular forces has advanced very greatly in recent years. It has become possible to carry out accurate calculations of intermolecular forces for molecules of useful size, and to apply the results to important practical applications such as understanding protein structure and function, and predicting the structures of molecular crystals. The Theory of Intermolecular Forces sets out the mathematical techniques that are needed to describe and calculate intermolecular interactions and to handle the more elaborate mathematical models. It describes the methods that are used to calculate them, including recent developments in the use of density functional theory and symmetry-adapted perturbation theory. The use of higher-rank multipole moments to describe electrostatic interactions is explained in both Cartesian and spherical tensor formalism, and methods that avoid the multipole expansion are also discussed. Modern ab initio perturbation theory methods for the calculation of intermolecular interactions are discussed in detail, and methods for calculating properties of molecular clusters and condensed matter for comparison with experiment are surveyed.

`Non-equilibrium Thermodynamics and Statistical Mechanics: Foundations and Applications' builds from basic principles to advanced techniques, and covers the major phenomena, methods, and results of time-dependent systems. It is a pedagogic introduction, a comprehensive reference manual, and an original research monograph. Uniquely, the book treats time-dependent systems by close analogy with their static counterparts, with most of the familiar results of equilibrium thermodynamics and statistical mechanics being generalized and applied to the non-equilibrium case. The book is notable for its unified treatment of thermodynamics, hydrodynamics, stochastic processes, and statistical mechanics, for its self-contained, coherent derivation of a variety of non-equilibrium theorems, and for its quantitative tests against experimental measurements and computer simulations. Systems that evolve in time are more common than static systems, and yet until recently they lacked any over-arching theory. 'Non-equilibrium Thermodynamics and Statistical Mechanics' is unique in its unified presentation of the theory of non-equilibrium systems, which has now reached the stage of quantitative experimental and computational verification. The novel perspective and deep understanding that this book brings offers the opportunity for new direction and growth in the study of time-dependent phenomena. 'Non-equilibrium Thermodynamics and Statistical Mechanics' is an invaluable reference manual for experts already working in the field. Research scientists from different disciplines will find the overview of time-dependent systems stimulating and thought-provoking. Lecturers in physics and chemistry will be excited by many fresh ideas and topics, insightful explanations, and new approaches. Graduate students will benefit from its lucid reasoning and its coherent approach, as well as from the chem12physof mathematical techniques, derivations, and computer algorithms.

Kinetic Theory of Granular Gases provides an introduction to the rapidly developing theory of dissipative gas dynamics - a theory which has mainly evolved over the last decade. The book is aimed at readers from the advanced undergraduate level upwards and leads on to the present state of research. Throughout, special emphasis is put on a microscopically consistent description of pairwise particle collisions which leads to an impact-velocity-dependent coefficient of restitution. The description of the many-particle system, based on the Boltzmann equation, starts with the derivation of the velocity distribution function, followed by the investigation of self-diffusion and Brownian motion. Using hydrodynamical methods, transport processes and self-organized structure formation are studied.
An appendix gives a brief introduction to event-driven molecular dynamics. A second appendix describes a novel mathematical technique for derivation of kinetic properties, which allows for the application of computer algebra. The text is self-contained, requiring no mathematical or physical knowledge beyond that of standard physics undergraduate level. The material is adequate for a one-semester course and contains chapter summaries as well as exercises with detailed solutions. The molecular dynamics and computer-algebra programs can be downloaded from a companion web page.

The crystallization of proteins and nucleic acids and/or their complexes has become more highly automated but is still often a trial and error based approach. In parallel, a number of X-ray diffraction based techniques have been developed which explain the physical reasons limiting the resulting crystallographic data and thus show how that data may be improved. Crystal growth is also pivotal in neutron crystallography, which establishes the hydrogen and hydration aspects. Thus this book is aimed at addressing the science behind obtaining the best and most complete structural data possible for biological macromolecules, so that the detailed structural biology and chemistry of these important molecules emerge. Crystal imperfections such as twinning and lattice disorders, as well as multiple crystal situations, and their possible remedies, are also described. The small crystal frontier in micro-crystal crystallography, crystallites in powders and finally down to the proposed single molecule structure determination of X-ray lasers are covered. Overall this interdisciplinary book will interest crystal growers, X-ray and neutron physicists and the biological crystallographers, including graduate students.

Scattering theory provides a framework for understanding the scattering of waves and particles. This book presents a simple physical picture of diffractive nuclear scattering in terms of semi-classical trajectories, illustrated throughout with examples and case studies. Trajectories in a complex impact parameter plane are discussed, and it stresses the importance of the analytical properties of the phase shift function in this complex impact plane in the asymptotic limit. Several new rainbow phenomena are also discussed and illustrated. Written by Nobel Prize winner Roy J. Glauber, and Per Osland, an expert in the field of particle physics, the book illustrates the transition from quantum to classical scattering, and provides a valuable resource for researchers using scattering theory in nuclear, particle, atomic and molecular physics.

There exists a wide variety of patterns in nature, from inert matter such as crystalline dendrites and flames, to filamentous fungi and neurones in the living world. Their structural evolution during growth can be theoretically modeled in order to predict the shape of their forms, their dimensions and their growth rate. New Visions on Growth and Form aims at answering such questions by employing different theoretical approaches and providing a critical appraisal.
The book is part of the wide field of non-equilibrium statistical physics, and explores different mechanisms such as transport, interfacial tension, and chemical reactions, which govern the growth of a material. It explains the fundamental equations relating different morphological quantities, as well as the relevant experimental control parameters. From the unifying concepts arising in the theoretical approach the author proposes a tentative description of cell morphogenesis as a further application of the theory.

Advances in Chemical Physics, Volume 127 covers recent advances at the cutting edge of research relative to chemical physics. The series, Advances in Chemical Physics, provides a forum for critical, authoritative evaluations of advances in every area of the discipline.

The 'Advances in Chemical Physics' series provides the chemical physics field with a forum for critical, authoritative evaluations of advances in every area of the discipline. This special volume focuses on atoms and photos near meso- and nanobodies, an important area of nontechnology.

The latest edition of the leading forum in chemical physics

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 126 covers a wide range of subjects, with significant, up-to-date chapters by internationally recognized researchers. The editors collect innovative papers on "Calculations of Nonlinear Optical Properties for the Solid State," "Itinerant Oscillator Models of Fluids," "Statistical Mechanics of Static and Low-Velocity Kinetic Friction," and several other related topics. Advances in Chemical Physics remains the premier venue for presentations of new findings in its field.

This book provides an introduction to optical multidimensional coherent spectroscopy, a relatively new method of studying materials based on using ultrashort light pulses to perform spectroscopy. The technique has been developed and perfected over the last 25 years, resulting in multiple experimental approaches and applications to a broad array of systems ranging from atoms and molecules to solids and biological systems. Indeed, while this method is most often used by physical chemists, it is also relevant to materials of interest to physicists, which is the primary focus of this book. As well as an introduction to the method, the book also provides tutorials on the interpretation of the rather complex spectra that is broadly applicable across all subfields, and finishes with a survey of several emerging material systems and a discussion of future directions.

The Advances in Chemical Physics series presents the cutting edge in every area of the discipline and provides the field with a forum for critical, authoritative evaluations of advances. It provides an editorial framework that makes each volume an excellent supplement to advanced graduate classes, with contributions from experts around the world and a handy glossary for easy reference on new terminology. This series is a wonderful guide for students and professionals in chemical physics and physical chemistry, from academia, government, and industries including chemicals, pharmaceuticals, and polymers.

This series provides the chemical physics field with a forum for critical, authoritative evaluations of advances in every area of the discipline.

This prestigious series provides the chemical physics field with a forum for critical, authoritative evaluations of advances in every area of the discipline. Volume 112 continues to report on recent advances through significant, up-to-date chapters by internationally recognized researchers.

Recent advances from internationally recognized researchers

Advances in Chemical Physics is the only series of volumes available to represent the cutting edge of research in the discipline. It creates a forum for critical, authoritative evaluations of advances in every area of the chemical physics field. Volume 128 continues to report recent developments with significant, up-to-date chapters by internationally recognized researchers. Volume 128 includes: "Nucleation in Polymer Crystallization," by M. Muthukumar; "Theory of Constrained Brownian Motion," by David C. Morse; "Superparamagnetism and Spin-glass Dynamics of Interacting Magnetic Nanoparticle Systems," by Petra E. Jönnson; "Wavepacket Theory of Photodissociation and Reactive Scattering," by Gabriel G. Balint-Kurti; and "The Momentum Density Perspective of the Electronic Structure of Atoms and Molecules," by Ajit J. Thakkar. Students and professionals in chemical physics and physical chemistry, as well as those working in the chemical, pharmaceutical, and polymer industries, will find Advances in Chemical Physics, Volume 128 to be an indispensable survey of the field.

This book provides a practical guide to molecular dynamics and Monte Carlo simulation techniques used in the modelling of simple and complex liquids. Computer simulation is an essential tool in studying the chemistry and physics of condensed matter, complementing and reinforcing both experiment and theory. Simulations provide detailed information about structure and dynamics, essential to understand the many fluid systems that play a key role in our daily lives: polymers, gels, colloidal suspensions, liquid crystals, biological membranes, and glasses. The second edition of this pioneering book aims to explain how simulation programs work, how to use them, and how to interpret the results, with examples of the latest research in this rapidly evolving field. Accompanying programs in Fortran and Python provide practical, hands-on, illustrations of the ideas in the text.

This book consists of over 422 problems and their acceptable answers on structural inorganic chemistry at the senior undergraduate and beginning graduate level. The central theme running through these questions is symmetry, bonding and structure: molecular or crystalline. A wide variety of topics are covered, including Electronic States and Configurations of Atoms and Molecules, Introductory Quantum Chemistry, Atomic Orbitals, Hybrid Orbitals, Molecular Symmetry, Molecular Geometry and Bonding, Crystal Field Theory, Molecular Orbital Theory, Vibrational Spectroscopy, Crystal Structure, Transition Metal Chemistry, Metal Clusters: Bonding and Reactivity, and Bioinorganic Chemistry. The questions collected here originate from the examination papers and take-home assignments arising from the teaching of courses in Chemical Bonding, Elementary Quantum Chemistry, Advanced Inorganic Chemistry, and X-Ray Crystallography by the book's two senior authors over the past five decades. The questions have been tested by generations of students taking these courses. The questions in this volume cover essentially all the topics in a typical course in structural inorganic chemistry. The text may be used as a supplement for a variety of inorganic chemistry courses at the senior undergraduate level. It also serves as a problem text to accompany the book Advanced Structural Inorganic Chemistry, co-authored by W.-K. Li, G.-D. Zhou, and T. C. W. Mak (Oxford University Press, 2008).

This book presents the main principles and methods of nonequilibrium statistical mechanics, a topic studied by both chemists and physicists. It is written for graduate students and scientists who already have knowledge of basic equilibrium statistical mechanics and who are interested in the more complex field of time-dependent nonequilibrium statistical mechanics.