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Author : W. H. Butler
Publisher : Unknown
Page : 560 pages
File Size : 48,7 Mb
Release : 1992-04-14
Category : Science
ISBN : UOM:39015025274310
The MRS Symposium Proceeding series is an internationally recognised reference suitable for researchers and practitioners.
Author : Antonios Gonis,William H. Butler
Publisher : Springer Science & Business Media
Page : 298 pages
File Size : 45,6 Mb
Release : 2012-12-06
Category : Science
ISBN : 9781461212904
A description of general techniques for solving linear partial differential equations by dividing space into regions to which the equations are independently applied and then assembling a global solution from the partial ones. Intended for researchers and graduates involved in calculations of the electronic structure of materials, this will also be of interest to workers in quantum chemistry, electron microscopy, acoustics, optics, and other fields. The book begins with an intuitive approach to scattering theory and then turns to partial waves and a formal development of multiple scattering theory, with applications to the solid state. The authors then present a variational derivation of the formalism and an augmented version of the theory, concluding with a discussion of the relativistic formalism and a discussion of the Poisson equation. Appendices discuss Green's functions, spherical functions, Moller operators and the Lippmann-Schwinger equation, irregular solutions, and singularities in Green's functions.
Author : J.L. Morán-López,José M. Sánchez
Publisher : Springer Science & Business Media
Page : 457 pages
File Size : 45,5 Mb
Release : 2013-11-11
Category : Science
ISBN : 9781489913340
During August 24-27, 1993, approximately 60 scientists from the Americas, Europe and Japan, gathered in the city of Guanajuato, in the state of Guanajuato, Mexico, at the II Latin American Workshop on Magnetism, Magnetic Materials and their Applications. The group of scientists converging into the beautiful city of Guanajuato had come from Argentina, Chile, Brazil, Venezuela, Cuba, several places in Mexico, U. S. A. , Japan, Spain, France, Italy, Germany, Austria, Switzerland, and Denmark. The event attested to the success of the previous Workshop on Magnetism, Magnetic Materials and their Applications, held in Havana, Cuba, in 1991, as well as to the interest, level of activity and quality of the work being carried out in Latin America in the area of magnetism and magnetic materials. Equally important to everyone present was the fact that we had come to honor a friend, Professor L. M. Falicov, on his sixtieth birthday. The choice of a Latin American Workshop on magnetism as a Festschrift for Leo Falicov was, in our opinion, quite appropriate not only because of Leo's strong ties to Latin America, but also because of his superb contributions to science, and in particular, to magnetism. Professor Falicov was born in Buenos Aires, Argentina, where he spent a good part of his formative years.
Author : A. Gonis,Josef Kudrnovský,Patrice E.A. Turchi
Publisher : Springer Science & Business Media
Page : 742 pages
File Size : 49,8 Mb
Release : 2012-12-06
Category : Science
ISBN : 9781461303855
Engineering materials with desirable physical and technological properties requires understanding and predictive capability of materials behavior under varying external conditions, such as temperature and pressure. This immediately brings one face to face with the fundamental difficulty of establishing a connection between materials behavior at a microscopic level, where understanding is to be sought, and macroscopic behavior which needs to be predicted. Bridging the corresponding gap in length scales that separates the ends of this spectrum has been a goal intensely pursued by theoretical physicists, experimentalists, and metallurgists alike. Traditionally, the search for methods to bridge the length scale gap and to gain the needed predictive capability of materials properties has been conducted largely on a trial and error basis, guided by the skill of the metallurgist, large volumes of experimental data, and often ad hoc semi phenomenological models. This situation has persisted almost to this day, and it is only recently that significant changes have begun to take place. These changes have been brought about by a number of developments, some of long standing, others of more recent vintage.
Author : Volker Eyert
Publisher : Springer
Page : 379 pages
File Size : 54,9 Mb
Release : 2012-12-14
Category : Science
ISBN : 9783642258640
The Augmented Spherical Wave (ASW) method is one of the most powerful approaches to handle the requirements of finite basis sets in DFT calculations. It is particularly suited for the calculation of the electronic, magnetic, and optical properties of solid-state materials. Recent developments allow application, in addition, to the elastic properties and phonon spectra. Due to the localized nature of the ASW basis set these properties can be easily interpreted in terms of atomic-like orbitals. The book addresses all those who want to learn about methods for electronic structure calculations and the ASW method in particular. This new edition has been thoroughly revised and extended. In particular, a chapter on the new, both very efficient and accurate spherical-wave based full potential ASW method has been added.
Author : Ilja Turek,Václav Drchal,Josef Kudrnovský,Mojmír Sob,Peter Weinberger
Publisher : Springer Science & Business Media
Page : 327 pages
File Size : 44,5 Mb
Release : 2013-11-27
Category : Science
ISBN : 9781461562559
At present, there is an increasing interest in the prediction of properties of classical and new materials such as substitutional alloys, their surfaces, and metallic or semiconductor multilayers. A detailed understanding based on a thus of the utmost importance for fu microscopic, parameter-free approach is ture developments in solid state physics and materials science. The interrela tion between electronic and structural properties at surfaces plays a key role for a microscopic understanding of phenomena as diverse as catalysis, corrosion, chemisorption and crystal growth. Remarkable progress has been made in the past 10-15 years in the understand ing of behavior of ideal crystals and their surfaces by relating their properties to the underlying electronic structure as determined from the first principles. Similar studies of complex systems like imperfect surfaces, interfaces, and mul tilayered structures seem to be accessible by now. Conventional band-structure methods, however, are of limited use because they require an excessive number of atoms per elementary cell, and are not able to account fully for e.g. substitu tional disorder and the true semiinfinite geometry of surfaces. Such problems can be solved more appropriately by Green function techniques and multiple scattering formalism.
Author : Jorge Kohanoff
Publisher : Cambridge University Press
Page : 339 pages
File Size : 48,6 Mb
Release : 2006-06-29
Category : Science
ISBN : 9781139453486
Electronic structure problems are studied in condensed matter physics and theoretical chemistry to provide important insights into the properties of matter. This 2006 graduate textbook describes the main theoretical approaches and computational techniques, from the simplest approximations to the most sophisticated methods. It starts with a detailed description of the various theoretical approaches to calculating the electronic structure of solids and molecules, including density-functional theory and chemical methods based on Hartree-Fock theory. The basic approximations are thoroughly discussed, and an in-depth overview of recent advances and alternative approaches in DFT is given. The second part discusses the different practical methods used to solve the electronic structure problem computationally, for both DFT and Hartree-Fock approaches. Adopting a unique and open approach, this textbook is aimed at graduate students in physics and chemistry, and is intended to improve communication between these communities. It also serves as a reference for researchers entering the field.
Author : Cristina Artini
Publisher : CRC Press
Page : 375 pages
File Size : 40,8 Mb
Release : 2017-07-12
Category : Science
ISBN : 9781351647656
This book focuses on the role of modeling in the design of alloys and intermetallic compounds. It includes an introduction to the most important and most used modeling techniques, such as CALPHAD and ab-initio methods, as well as a section devoted to the latest developments in applications of alloys. The book emphasizes the correlation between modeling and technological developments while discussing topics such as wettability of Ultra High Temperature Ceramics by metals, active brazing of diamonds to metals in cutting tools, surface issues in medicine, novel Fe-based superconductors, metallic glasses, high entropy alloys, and thermoelectric materials.
Author : James E. Mark,Steven P. Marsh
Publisher : Unknown
Page : 432 pages
File Size : 44,7 Mb
Release : 1992-09-23
Category : Technology & Engineering
ISBN : UOM:39015028462961
The MRS Symposium Proceeding series is an internationally recognised reference suitable for researchers and practitioners.
Author : Anonim
Publisher : Unknown
Page : 464 pages
File Size : 53,9 Mb
Release : 1992
Category : Electronic packaging
ISBN : UOM:39015029162685
Author : P. S. Ho
Publisher : Unknown
Page : 464 pages
File Size : 50,5 Mb
Release : 1992
Category : Composite materials
ISBN : UCSD:31822015049026
Author : D. T. Shaw
Publisher : Mrs Proceedings
Page : 960 pages
File Size : 41,8 Mb
Release : 1992-10-26
Category : Science
ISBN : UOM:39015029217752
The MRS Symposium Proceeding series is an internationally recognised reference suitable for researchers and practitioners.
Author : Chain Tsuan Liu
Publisher : Unknown
Page : 464 pages
File Size : 53,5 Mb
Release : 1992
Category : Alloys
ISBN : UOM:39015025205298
Author : Gerald L. Witt
Publisher : Unknown
Page : 320 pages
File Size : 52,9 Mb
Release : 1992-07-15
Category : Technology & Engineering
ISBN : UOM:39015025380703
The MRS Symposium Proceeding series is an internationally recognised reference suitable for researchers and practitioners.
Author : Ronald H. Baney
Publisher : Mrs Proceedings
Page : 208 pages
File Size : 55,8 Mb
Release : 1992-09-14
Category : Technology & Engineering
ISBN : UOM:39015029192088
The MRS Symposium Proceeding series is an internationally recognised reference suitable for researchers and practitioners.