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| Author | : Dionisios Gerasimos Vlachos |
| Publisher | : |
| Total Pages | : 428 |
| Release | : 1992 |
| Genre | : |
| ISBN | : |
| Author | : Anders Nilsson |
| Publisher | : Elsevier |
| Total Pages | : 533 |
| Release | : 2011-08-11 |
| Genre | : Science |
| ISBN | : 0080551912 |
Molecular surface science has made enormous progress in the past 30 years. The development can be characterized by a revolution in fundamental knowledge obtained from simple model systems and by an explosion in the number of experimental techniques. The last 10 years has seen an equally rapid development of quantum mechanical modeling of surface processes using Density Functional Theory (DFT). Chemical Bonding at Surfaces and Interfaces focuses on phenomena and concepts rather than on experimental or theoretical techniques. The aim is to provide the common basis for describing the interaction of atoms and molecules with surfaces and this to be used very broadly in science and technology. The book begins with an overview of structural information on surface adsorbates and discusses the structure of a number of important chemisorption systems. Chapter 2 describes in detail the chemical bond between atoms or molecules and a metal surface in the observed surface structures. A detailed description of experimental information on the dynamics of bond-formation and bond-breaking at surfaces make up Chapter 3. Followed by an in-depth analysis of aspects of heterogeneous catalysis based on the d-band model. In Chapter 5 adsorption and chemistry on the enormously important Si and Ge semiconductor surfaces are covered. In the remaining two Chapters the book moves on from solid-gas interfaces and looks at solid-liquid interface processes. In the final chapter an overview is given of the environmentally important chemical processes occurring on mineral and oxide surfaces in contact with water and electrolytes. Gives examples of how modern theoretical DFT techniques can be used to design heterogeneous catalysts This book suits the rapid introduction of methods and concepts from surface science into a broad range of scientific disciplines where the interaction between a solid and the surrounding gas or liquid phase is an essential component Shows how insight into chemical bonding at surfaces can be applied to a range of scientific problems in heterogeneous catalysis, electrochemistry, environmental science and semiconductor processing Provides both the fundamental perspective and an overview of chemical bonding in terms of structure, electronic structure and dynamics of bond rearrangements at surfaces
| Author | : J. M. Blakely |
| Publisher | : Elsevier |
| Total Pages | : 274 |
| Release | : 2013-10-22 |
| Genre | : Science |
| ISBN | : 148315680X |
Introduction to the Properties of Crystal Surfaces is an introductory text on crystal surfaces and their properties. A variety of phenomena, including electron emission, adsorption and oxidation, adhesion, friction, nucleation and epitaxial growth, and heterogeneous catalysis, are described by considering the details of the atomic and electronic structure in the surface region. This volume is comprised of seven chapters and begins with a discussion on the thermodynamics of surfaces, along with the equilibrium configuration at the intersection of interfaces and the effects of curvature of crystalline surfaces. The next chapter examines the properties of interfaces in multi-component systems, followed by an analysis of experimental measurements of surface tension in solids. The atomic structure of crystal surfaces and some theoretical aspects of surface studies are also considered, and experimental methods in used in such studies are outlined. The final chapter deals with two atomic processes that are involved in a number of reactions at crystal surfaces: surface atomic diffusion and adsorption. This book is intended for senior undergraduates in a materials science type of curriculum or those beginning research work in the field or associated areas.
| Author | : K. Christmann |
| Publisher | : Springer Science & Business Media |
| Total Pages | : 283 |
| Release | : 2013-06-29 |
| Genre | : Science |
| ISBN | : 3662080095 |
| Author | : G.F. Froment |
| Publisher | : Elsevier |
| Total Pages | : 611 |
| Release | : 1997-09-03 |
| Genre | : Technology & Engineering |
| ISBN | : 0080530621 |
Many processes of the chemical industry are based upon heterogeneous catalysis. Two important items of these processes are the development of the catalyst itself and the design and optimization of the reactor. Both aspects would benefit from rigorous and accurate kinetic modeling, based upon information on the working catalyst gained from classical steady state experimentation, but also from studies using surface science techniques, from quantum chemical calculations providing more insight into possible reaction pathways and from transient experimentation dealing with reactions and reactors. This information is seldom combined into a kinetic model and into a quantitative description of the process. Generally the catalytic aspects are dealt with by chemists and by physicists, while the chemical engineers are called upon for mechanical aspects of the reactor design and its control. The symposium "Dynamics of Surfaces and Reaction Kinetics in Heterogeneous Catalysis" aims at illustrating a more global and concerted approach through a number of prestigious keynote lectures and severely screened oral and poster presentations.
| Author | : Sidney Yip |
| Publisher | : Springer Science & Business Media |
| Total Pages | : 2903 |
| Release | : 2007-11-17 |
| Genre | : Science |
| ISBN | : 1402032862 |
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.
| Author | : |
| Publisher | : Elsevier |
| Total Pages | : 5276 |
| Release | : 2018-03-29 |
| Genre | : Science |
| ISBN | : 0128098945 |
Encyclopedia of Interfacial Chemistry: Surface Science and Electrochemistry, Seven Volume Set summarizes current, fundamental knowledge of interfacial chemistry, bringing readers the latest developments in the field. As the chemical and physical properties and processes at solid and liquid interfaces are the scientific basis of so many technologies which enhance our lives and create new opportunities, its important to highlight how these technologies enable the design and optimization of functional materials for heterogeneous and electro-catalysts in food production, pollution control, energy conversion and storage, medical applications requiring biocompatibility, drug delivery, and more. This book provides an interdisciplinary view that lies at the intersection of these fields. Presents fundamental knowledge of interfacial chemistry, surface science and electrochemistry and provides cutting-edge research from academics and practitioners across various fields and global regions
| Author | : H. Taub |
| Publisher | : Springer Science & Business Media |
| Total Pages | : 505 |
| Release | : 2012-12-06 |
| Genre | : Science |
| ISBN | : 1468459708 |
The Advanced Study Institute (AS I) entitled "Phase Transitions in Surface Films" was held at the Ettore Majorana Centre for Scientific Culture in Erice, Sicily from June 19 to June 29, 1990. It reviewed the present understanding (experimental and theoretical) of phase transitions of surfaces, interfaces, and thin ftlms as well as the related structural and dynamical properties of these systems. From its inception, this ASI was envisioned as a sequel to one of the same title organized eleven years earlier by J. G. Dash and J. Ruvalds which was also held at the Ettore Majorana Centre. The previous ASI reflected the progress which had been made in understanding quasi two-dimensional (2D) states of matter, particularly adsorbed monolayers, and the phase transitions which occur in them. At that time, the field was barely ten years old. The modern field to which we are referring here can be traced to the landmark experiments of A. Thorny and X. Duval. Beginning in 1967, they published a series of papers presenting evidence from vapor pressure measurements of 2D phases of krypton and other gases adsorbed on polycrystalline (exfoliated) graphite. Their work led to a large number of thermodynamic and scattering experiments on physisorbed ftlms. This in turn motivated a great deal of theoretical interest in 2D systems and their phase transitions.
| Author | : |
| Publisher | : Elsevier |
| Total Pages | : 901 |
| Release | : 1996-12-06 |
| Genre | : Technology & Engineering |
| ISBN | : 0080538959 |
The primary goal of this book is to summarize the current level of accumulated knowledge about the physical structure of solid surfaces with emphasis on well-defined surfaces at the gas-solid and vacuum-solid interfaces. The intention is not only to provide a standard reference for practitioners, but also to provide a good starting point for scientists who are just entering the field. The presentation in most of the chapters therefore assumes that the typical reader will have a good undergraduate background in chemistry, physics, or materials science. At the same time, coverage is comprehensive and at a high technical level with emphasis on fundamental physical principles. This first volume in a new series is appropriately devoted to the physical structure of surfaces, knowledge of which will be essential for a complete understanding of electronic properties and dynamical processes, the topics of the next two volumes in the series. The volume is divided into four parts. Part I describes the equilibrium properties of surfaces with emphasis on clean surfaces of bulk materials. Part II provides an introduction to some of the primary experimental methods that are used to determine surface crystal structures. Part III gives an overview of the vast topic of the structure of adsorbed layers. The concluding Part IV deals with the topics of defects in surface structures and phase transitions.
| Author | : |
| Publisher | : |
| Total Pages | : 240 |
| Release | : 1977 |
| Genre | : Adsorption |
| ISBN | : |
