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Small Organic Molecules on Surfaces
This book deals with basic aspects of polymer electronics and optoelectronics. There is an enormous world-wide effort both in basic scientific research as well as in industrial development in the area of organic electronics. It is becoming increasingly clear that, if devices based on organic materials are ever going to have a significant relevance beyond being a cheap replacement for inorganic semiconductors, there will be a need to understand interface formation, film growth and functionality. A control of these aspects will allow the realisation of totally new device concepts exploiting the enormous flexibility inherent in organic chemistry. In this book we focus on oligomeric/molecular films as we believe that the control of molecular structures and interfaces provides highly defined systems which allow, on the one hand the study of the basic physics and on the other hand to find the important parameters necessary to improve organic devices.
Methods and Applications of Autonomous Experimentation
Autonomous Experimentation is poised to revolutionize scientific experiments at advanced experimental facilities. Whereas previously, human experimenters were burdened with the laborious task of overseeing each measurement, recent advances in mathematics, machine learning and algorithms have alleviated this burden by enabling automated and intelligent decision-making, minimizing the need for human interference. Illustrating theoretical foundations and incorporating practitioners’ first-hand experiences, this book is a practical guide to successful Autonomous Experimentation. Despite the field’s growing potential, there exists numerous myths and misconceptions surrounding Autonomous Experimentation. Combining insights from theorists, machine-learning engineers and applied scientists, this book aims to lay the foundation for future research and widespread adoption within the scientific community. This book is particularly useful for members of the scientific community looking to improve their research methods but also contains additional insights for students and industry professionals interested in the future of the field.
Structure and Multiscale Mechanics of Carbon Nanomaterials
This book provides a broad overview on the relationship between structure and mechanical properties of carbon nanomaterials from world-leading scientists in the field. The main aim is to get an in-depth understanding of the broad range of mechanical properties of carbon materials based on their unique nanostructure and on defects of several types and at different length scales. Besides experimental work mainly based on the use of (in-situ) Raman and X-ray scattering and on nanoindentation, the book also covers some aspects of multiscale modeling of the mechanics of carbon nanomaterials.
Reviews in Computational Chemistry, Volume 27
This volume, like those prior to it, features chapters by experts in various fields of computational chemistry. Volume 27 covers brittle fracture, molecular detailed simulations of lipid bilayers, semiclassical bohmian dynamics, dissipative particle dynamics, trajectory-based rare event simulations, and understanding metal/metal electrical contact conductance from the atomic to continuum scales. Also included is a chapter on career opportunities in computational chemistry and an appendix listing the e-mail addresses of more than 2500 people in that discipline. FROM REVIEWS OF THE SERIES "Reviews in Computational Chemistry remains the most valuable reference to methods and techniques in computational chemistry." —JOURNAL OF MOLECULAR GRAPHICS AND MODELLING "One cannot generally do better than to try to find an appropriate article in the highly successful Reviews in Computational Chemistry. The basic philosophy of the editors seems to be to help the authors produce chapters that are complete, accurate, clear, and accessible to experimentalists (in particular) and other nonspecialists (in general)." —JOURNAL OF THE AMERICAN CHEMICAL SOCIETY
Handbook of Functionalized Carbon Nanostructures
This book highlights all newly reported carbon nanostructures including graphene and its derivatives, carbon nanotubes, metal organic frameworks, fullerenes, nanorods, nanospheres, nano onions, porous nanoparticles, nanohorns, nanofibers and nanoribbons, nanodiamonds, graphitic carbon nitrides, carbon aerogels and hydrogels, graphdiyne and graphenylene. It presents the historical development of carbon nanostructures technologies, different types and classifications, and different fabrication and functionalization techniques, including outer/inner surface functionalization and covalent and noncovalent functionalization. This Handbook discusses the unique properties of functionalized carbon na...
Physics and Materials Science of High Temperature Superconductors, II
Physics and Materials Science of High Temperature Superconductors, II represents the results of a fruitful dialogue between physicists and materials scientists which took place under the auspices of a NATO Advanced Study Institute in Porto Carras, Greece, between 18 and 31 August, 1991. It builds on and carries forward the success of NATO ASI 181 published in 1990. The theoretical side of the discussions reveal the basic premise of the phenomenological and Ginzburg-Landau theories of superconductivity, the implications of short coherence length, long penetration depth, the melting of flux lattices, and other matters, while the materials science includes discussions of microstructures, local ...
Introduction to Ultrafast Phenomena
This book, the first of this kind, provides a comprehensive introduction to ultrafast phenomena, covering the fundamentals of ultrafast spin and charge dynamics, femtosecond magnetism, all-optical spin switching, and high-harmonic generation. It covers the experimental tools, including ultrafast pump-probe experiments, and theoretical methods including quantum chemistry and density functional theory, both time-independent and time-dependent. The authors explain in clear language how an ultrafast laser pulse is generated experimentally, how it can induce rapid responses in electrons and spins in molecules, nanostructures and solids (magnetic materials and superconductors), and how it can crea...
Computer Simulations Of Molecules And Condensed Matter: From Electronic Structures To Molecular Dynamics
This book provides a relatively complete introduction to the methods used in computational condensed matter. A wide range of electronic structure theories are introduced, including traditional quantum chemistry methods, density functional theory, many-body perturbation theory, and more. Molecular dynamics simulations are also discussed, with extensions to enhanced sampling and free-energy calculation techniques including umbrella sampling, meta-dynamics, integrated tempering sampling, etc. As a further extension beyond the standard Born-Oppenheimer molecular dynamics, some simulation techniques for the description of quantum nuclear effects are also covered, based on Feynman's path-integral representation of quantum mechanics. The book aims to help beginning graduate students to set up a framework of the concepts they should know before tackling the physical/chemical problems they will face in their research.
International Tables for Crystallography, Volume I
X-ray absorption spectroscopy and X-ray emission spectroscopy are complementary to crystallographic methods, particularly for materials science and the study of nanostructure and systems with partial disorder and partial local order, including solutions, gases, liquids, glasses and powders. This new volume of International Tables for Crystallography has nine parts and over 150 chapters contributed by a wide range of international experts. Part 1 provides a brief overview and introduction to the background of X-ray absorption spectroscopy (XAS) and experimental facilities. Part 2 discusses the quantum theory of XAS and related approaches. Part 3 describes both standard and advanced experiment...
Attosecond Experiments on Plasmonic Nanostructures
Johannes Schötz presents the first measurements of optical electro-magnetic near-fields around nanostructures with subcycle-resolution. The ability to measure and understand light-matter interactions on the nanoscale is an important component for the development of light-wave-electronics, the control and steering of electron dynamics with the frequency of light, which promises a speed-up by several orders of magnitude compared to conventional electronics. The experiments presented here on metallic nanotips, widely used in experiments and applications, do not only demonstrate the feasibility of attosecond streaking as a unique tool for fundamental studies of ultrafast nanophotonics but also represent a first important step towards this goal.
