Download or read book Handbook of Materials Modeling written by Sidney Yip and published by Springer Science & Business Media. This book was released on 2007-11-17 with total page 2903 pages. Available in PDF, EPUB and Kindle. Book excerpt: The first reference of its kind in the rapidly emerging field of computational approachs to materials research, this is a compendium of perspective-providing and topical articles written to inform students and non-specialists of the current status and capabilities of modelling and simulation. From the standpoint of methodology, the development follows a multiscale approach with emphasis on electronic-structure, atomistic, and mesoscale methods, as well as mathematical analysis and rate processes. Basic models are treated across traditional disciplines, not only in the discussion of methods but also in chapters on crystal defects, microstructure, fluids, polymers and soft matter. Written by authors who are actively participating in the current development, this collection of 150 articles has the breadth and depth to be a major contributor toward defining the field of computational materials. In addition, there are 40 commentaries by highly respected researchers, presenting various views that should interest the future generations of the community. Subject Editors: Martin Bazant, MIT; Bruce Boghosian, Tufts University; Richard Catlow, Royal Institution; Long-Qing Chen, Pennsylvania State University; William Curtin, Brown University; Tomas Diaz de la Rubia, Lawrence Livermore National Laboratory; Nicolas Hadjiconstantinou, MIT; Mark F. Horstemeyer, Mississippi State University; Efthimios Kaxiras, Harvard University; L. Mahadevan, Harvard University; Dimitrios Maroudas, University of Massachusetts; Nicola Marzari, MIT; Horia Metiu, University of California Santa Barbara; Gregory C. Rutledge, MIT; David J. Srolovitz, Princeton University; Bernhardt L. Trout, MIT; Dieter Wolf, Argonne National Laboratory.
Download or read book Controlling the Quantum World written by National Research Council and published by National Academies Press. This book was released on 2007-06-21 with total page 245 pages. Available in PDF, EPUB and Kindle. Book excerpt: As part of the Physics 2010 decadal survey project, the Department of Energy and the National Science Foundation requested that the National Research Council assess the opportunities, over roughly the next decade, in atomic, molecular, and optical (AMO) science and technology. In particular, the National Research Council was asked to cover the state of AMO science, emphasizing recent accomplishments and identifying new and compelling scientific questions. Controlling the Quantum World, discusses both the roles and challenges for AMO science in instrumentation; scientific research near absolute zero; development of extremely intense x-ray and laser sources; exploration and control of molecular processes; photonics at the nanoscale level; and development of quantum information technology. This book also offers an assessment of and recommendations about critical issues concerning maintaining U.S. leadership in AMO science and technology.
Download or read book Nanostructured and Photoelectrochemical Systems for Solar Photon Conversion written by Mary D. Archer and published by Imperial College Press. This book was released on 2008 with total page 781 pages. Available in PDF, EPUB and Kindle. Book excerpt: In this book, expert authors describe advanced solar photon conversion approaches that promise highly efficient photovoltaic and photoelectrochemical cells with sophisticated architectures on the one hand, and plastic photovoltaic coatings that are inexpensive enough to be disposable on the other. Their leitmotifs include light-induced exciton generation, junction architectures that lead to efficient exciton dissociation, and charge collection by percolation through mesoscale phases. Photocatalysis is closely related to photoelectrochemistry, and the fundamentals of both disciplines are covered in this volume.
Download or read book Conjugated Polymer And Molecular Interfaces written by William R. Salaneck and published by CRC Press. This book was released on 2001-10-18 with total page 896 pages. Available in PDF, EPUB and Kindle. Book excerpt: Defines the state-of-the-art in interface science for electronic applications of organic materials. Updates understanding of the foundaiton of interfacial properties. Describes novel electronic devices created from conjugated polymers and organic molecular solids.
Download or read book Charge and Energy Transfer Dynamics in Molecular Systems written by Volkhard May and published by John Wiley & Sons. This book was released on 2011-04-27 with total page 600 pages. Available in PDF, EPUB and Kindle. Book excerpt: This 3rd edition has been expanded and updated to account for recent developments, while new illustrative examples as well as an enlarged reference list have also been added. It naturally retains the successful concept of its predecessors in presenting a unified perspective on molecular charge and energy transfer processes, thus bridging the regimes of coherent and dissipative dynamics, and establishing a connection between classic rate theories and modern treatments of ultrafast phenomena. Among the new topics are: - Time-dependent density functional theory - Heterogeneous electron transfer, e.g. between molecules and metal or semiconductor surfaces - Current flows through a single molecule. While serving as an introduction for graduate students and researchers, this is equally must-have reading for theoreticians and experimentalists, as well as an aid to interpreting experimental data and accessing the original literature.
Download or read book Principles of Molecular Photochemistry An Introduction written by Nicholas J. Turro and published by University Science Books. This book was released on 2009-01-16 with total page 522 pages. Available in PDF, EPUB and Kindle. Book excerpt: This text develops photochemical and photophysical concepts from a set of familiar principles. Principles of Molecular Photochemistry provides in-depth coverage of electronic spin, the concepts of electronic energy transfer and electron transfer, and the progress made in theoretical and experimental electron transfer.
Download or read book Molecular Nano Dynamics written by Hiroshi Fukumura and published by John Wiley & Sons. This book was released on 2009-09-09 with total page 740 pages. Available in PDF, EPUB and Kindle. Book excerpt: From artificial surfaces to living cells, Molecular Nano Dynamics, Vol. I and Vol. II explores more than 40 important methods for dynamic observation of the nanoscale. Edited by absolute science greats from Japan, this two-volume set covers all important aspects of this topic: nanoscale spectroscopy and characterization tools, nanostructure dynamics, single living cell dynamics, active surfaces, and single crystals. Destined to be the definitive reference work on nanoscale molecular dynamics and their observation for years to come, this is a must-have reference for chemists, physicists, physical chemists, theoretical chemists, and materials scientists.
Download or read book Proceedings of the Twenty First DOE Solar Photochemistry Research Conference written by and published by . This book was released on 1997 with total page 232 pages. Available in PDF, EPUB and Kindle. Book excerpt:
Download or read book Charge and Exciton Transport through Molecular Wires written by Laurens D. A. Siebbeles and published by John Wiley & Sons. This book was released on 2011-07-18 with total page 293 pages. Available in PDF, EPUB and Kindle. Book excerpt: As functional elements in opto-electronic devices approach the singlemolecule limit, conducting organic molecular wires are the appropriate interconnects that enable transport of charges and charge-like particles such as excitons within the device. Reproducible syntheses and a thorough understanding of the underlying principles are therefore indispensable for applications like even smaller transistors, molecular machines and light-harvesting materials. Bringing together experiment and theory to enable applications in real-life devices, this handbook and ready reference provides essential information on how to control and direct charge transport. Readers can therefore obtain a balanced view of charge and exciton transport, covering characterization techniques such as spectroscopy and current measurements together with quantitative models. Researchers are thus able to improve the performance of newly developed devices, while an additional overview of synthesis methods highlights ways of producing different organic wires. Written with the following market in mind: chemists, molecular physicists, materials scientists and electrical engineers.
Download or read book Testing Molecular Wires written by Mateusz Wielopolski and published by Springer Science & Business Media. This book was released on 2010-11-02 with total page 190 pages. Available in PDF, EPUB and Kindle. Book excerpt: This is a major contribution to the field of charge transport through organic pi-conjugated molecules. Besides its impact on molecular electronics, the work also applies to the design and development of light harvesting, photoconversion and catalytic modules.
Download or read book Bioinorganic Electrochemistry written by Ole Hammerich and published by Springer Science & Business Media. This book was released on 2008 with total page 319 pages. Available in PDF, EPUB and Kindle. Book excerpt: Interfacial electrochemistry of redox metalloproteins and DNA-based molecules is presently moving towards new levels of structural and functional resolution. This is the result of powerful interdisciplinary efforts. Underlying fundamentals of biological electron and proton transfer is increasingly well understood although with outstanding unresolved issues. Comprehensive bioelectrochemical studies have mapped the working environments for bioelectrochemical electron transfer, supported by the availability of mutant proteins and other powerful biotechnology. Introduction of surface spectroscopy, the scanning probe microscopies, and other solid state and surface physics methodology has finally offered exciting new fundamental and technological openings in interfacial bioelectrochemistry of both redox proteins and DNA-based molecules. Inorganic Bioelectrochemistry provides a thorough and didactic overview of state-of-the-art bioelectrochemistry with prospects for forthcoming development. The book is organized in eight chapters written by leading international experts and covers crucial relevant topics such as electron and proton transfer in metalloprotein systems, electrochemistry and electrocatalysis of redox enzymes, and electrochemistry of DNA-based molecules. A wide variety of readers will find this volume of great interest. These include final year undergraduate and postgraduate students, university lecturers in inorganic and physical chemistry as well as the biochemical and biological sciences, and research staff in medical and biotechnological companies, catalysis research, and other industries.
Download or read book Functional Organic Materials written by Thomas J. J. Müller and published by John Wiley & Sons. This book was released on 2007-02-27 with total page 612 pages. Available in PDF, EPUB and Kindle. Book excerpt: This timely overview of the syntheses for functional pi-systems focuses on target molecules that have shown interesting properties as materials or models in physics, biology and chemistry. The unique concept allows readers to select the right synthetic strategy for success, making it invaluable for a number of industrial applications. A "must have" for everyone working in this new and rapidly expanding field.
Download or read book Environmentally Benign Photocatalysts written by Masakazu Anpo and published by Springer Science & Business Media. This book was released on 2010-11-11 with total page 740 pages. Available in PDF, EPUB and Kindle. Book excerpt: Over the past few decades, mankind has observed an unprecedented and remarkable growth in industry, resulting in a more prosperous lifestyle for peoples of many countries. In developing countries, however, explosive industrial growth is just now beginning to raise the living standards of the people. Most industries, especially in these developing countries, are still powered by the burning of fossil fuels; con- quently, a lack of clean energy resources has caused environmental pollution on an unprecedented large and global scale. Toxic wastes have been relentlessly released into the air and water leading to serious and devastating environmental and health problems while endangering the planet and life itself with the effects of global warming. To address these urgent environmental issues, new catalytic and photocatalytic processes as well as open-atmospheric systems are presently being developed that can operate at room temperature while being totally clean and ef?cient and thus environmentally harmonious. Essential to technologies harnessing the abundant solar energy that reaches the earth are the highly functional photocatalytic proce- es that can utilize not only UV light, but also visible light.
Download or read book Molecular Devices and Machines written by Vincenzo Balzani and published by John Wiley & Sons. This book was released on 2008-04-09 with total page 588 pages. Available in PDF, EPUB and Kindle. Book excerpt: Targeted at a broad audience ranging from chemists and biochemists to physicists and engineers, this book covers advanced research while being written in an easily understandable language accessible to any interested researcher or graduate student. Following an introduction to the general concepts, the authors go on to discuss devices for processing electrons and electronic energy, memories, logic gates and related systems, and, finally, molecular-scale machines.
Download or read book Molecular Photonics written by Kazuyuki Horie and published by John Wiley & Sons. This book was released on 2008-07-11 with total page 216 pages. Available in PDF, EPUB and Kindle. Book excerpt: New organic compounds with interesting and improved electronic and photonic properties are being reported on a daily basis, with new light-triggered materials being designed for molecular and bioelectronic devices. The relatively new concept of molecular photonics embraces photochemistry and photophysics, dealing with light-induced changes in materials and their electronic states as well as the field of optics. This volume begins with a background and survey of current light-related research fields, moving on to the fundamentals of molecular photonics. Subsequent chapters deal with the characteristics of photochemical reaction and typical processes of photophysical chemistry, while the last two chapters focus on the study of materials-induced changes in light. The most important concepts are summarized in overview tables to promote active understanding of new topics. .
Download or read book Scientific and Technical Aerospace Reports written by and published by . This book was released on 1992 with total page 1572 pages. Available in PDF, EPUB and Kindle. Book excerpt:
Download or read book Designing Dendrimers written by Sebastiano Campagna and published by John Wiley & Sons. This book was released on 2011-09-26 with total page 726 pages. Available in PDF, EPUB and Kindle. Book excerpt: Research on dendrimers has exploded in the last 15 years, moving from the establishment of synthetic methodologies, particularly in the early years up to the end of nineties, towards sophisticated and wide-ranging applications. Dendrimers play an important role in many different areas, spanning from basic synthetic approaches to artificial photosynthesis, to medicine, to catalysis. The great potential of dendrimers is well-recognized by the hundreds of papers in the field and the increasing number of patents, and stimulated developments in other areas of knowledge, including new characterization techniques. However, some basic principles and methods still continue to give a unity to the field. Although several books on dendrimers have been published during these 15 years, the very recent progresses in new areas now requires a new point of view, trying to give a unifying and comprehensive outlook of the field. Since the first dendrimer was synthesized by Vögtle in 1978, dendrimers have experienced an explosion of scientific interest because of their unique molecular architecture. This resulted in over 5,000 scientific papers and patents published by the end of 2005. The proposed book will cover both fundamental and applicative aspects of dendrimer research. Chapters devoted to basic principles, synthetic methods and strategies, and advanced characterization techniques will be integrated by chapters illustrating the full potential of dendrimers in various fields, like artificial photosynthesis, multi-redox pool systems, diagnostics, biomedical and sensing purposes, design of functional nanostructures. Particular emphasis will be devoted to possible future developments.
