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A modern, comprehensive text and reference describing intermolecular forces, this book begins with coverage of the concepts and methods for simpler systems, then moves on to more advanced subjects for complex systems – emphasizing concepts and methods used in calculations with realistic models and compared with empirical data. Contains applications to many physical systems and worked examples Proceeds from introductory material to advanced modern treatments Has relevance for new materials, biological phenomena, and energy and fuels production
Quantum phenomena are ubiquitous in complex molecular systems - as revealed by many experimental observations based upon ultrafast spectroscopic techniques - and yet remain a challenge for theoretical analysis. The present volume, based on a May 2005 workshop, examines and reviews the state-of-the-art in the development of new theoretical and computational methods to interpret the observed phenomena. Emphasis is on complex molecular processes involving surfaces, clusters, solute-solvent systems, materials, and biological systems. The research summarized in this book shows that much can be done to explain phenomena in systems excited by light or through atomic interactions. It demonstrates ho...
This series, Finite Systems and Multiparticle Dynamics, is intended to provide timely reviews of current research topics, written in a style sufficiently pedagogic so as to allow a nonexpert to grasp the underlying ideas as well as understand technical details. The series is an outgrowth of our involvement with three interdis ciplinary activities, namely, those arising from the American Physical Society's Topical Group on Few Body Systems and Multiparticle Dynam ics, the series of Gordon Research Conferences first known by the title "Few Body Problems in Chemistry and Physics" and later renamed "Dynamics of Simple Systems in Chemistry and Physics," and the series of Sanibel Symposia, sponsor...
The role of quantum coherence in promoting the e ciency of the initial stages of photosynthesis is an open and intriguing question. Lee, Cheng, and Fleming, Science 316, 1462 (2007) The understanding and design of functional biomaterials is one of today’s grand challenge areas that has sparked an intense exchange between biology, materials sciences, electronics, and various other disciplines. Many new - velopments are underway in organic photovoltaics, molecular electronics, and biomimetic research involving, e. g. , arti cal light-harvesting systems inspired by photosynthesis, along with a host of other concepts and device applications. In fact, materials scientists may well be advised to...
This series, Finite Systems and Multipartide Dynamics, is intended to provide timely reviews of current research topics, written in a style sufficient ly pedagogic so as to allow a nonexpert to grasp the underlying ideas as well as understand technical details. The series is an outgrowth of our involvement with three interdisciplin ary activities, namely, those arising from the American Physical Society's Topical Group on Few-Body Systems and Multipartide Dynamics, the series of Gordon Research Conferences first known by the title "Few-Body Problems in Chemistry and Physics" and later renamed "Dynamics of Simple Systems in Chemistry and Physics," and the series of Sanibel Symposia, sponsored...
Kinetics in Condensed Matter and at Surfaces covers the basic concepts of mean force and diffusion, response to external fields and to driving forces, stochastic descriptions, and classical dynamics simulations. It also deals with energy and electron transfer, reactions in liquids and solids, photoinduced kinetics, and kinetics at surfaces. It introduces realistic intermolecular forces and computational methods needed to interpret experiments and predict the outcome of measurements. The two final chapters give introductions to density matrix theory and to relaxation and dissipative phenomena. Chapters provide an introduction to experimental methods where appropriate, and connect theory to applications for specific physical systems to obtain results that can be compared to experimental data.
Molecular Collisions and Gaseous Kinetics covers elastic collisions, inelastic collisions leading to energy transfer and electronic transitions, reactive collisions, and photoinduced dynamics. Collisions with surfaces, thermal rates of those phenomena, as well as transport and relaxation phenomena mediated by molecular collisions are also discussed. A final chapter on many-atom scattering theory serves as an introduction to more advanced descriptions. The treatment is based on the quantal theory of scattering and its semiclassical limits, introduces realistic intermolecular forces, and includes computational aspects needed to calculate cross-sections and compare them with experimental data. It is motivated by a need to cover these subjects starting from the electronic structure and atomic conformation of molecules. The chapters provide an introduction to experimental methods where appropriate, and connect theory to applications for specific physical systems to obtain results that can be compared to experimental data.