Lectures On Methods Of Electronic Structure Calculations
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Lectures On Methods Of Electronic Structure Calculations Proceedings Of The Miniworkshop On Methods Of Electronic Structure Calculations And Working Group On Disordered Alloys
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Author : Ole Krogh Andersen
language : en
Publisher: World Scientific
Release Date : 1995-02-23
Lectures On Methods Of Electronic Structure Calculations Proceedings Of The Miniworkshop On Methods Of Electronic Structure Calculations And Working Group On Disordered Alloys written by Ole Krogh Andersen and has been published by World Scientific this book supported file pdf, txt, epub, kindle and other format this book has been release on 1995-02-23 with Science categories.
Developments in the density functional theory and the methods of electronic structure calculations have made it possible to carry out ab-initio studies of a variety of materials efficiently and at a predictable level. This book covers many of those state-of-the-art developments and their applications to ordered and disordered materials, surfaces and interfaces and clusters, etc.
Electronic Structure Of Alloys Surfaces And Clusters
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Author : Abhijit Mookerjee
language : en
Publisher: CRC Press
Release Date : 2002-11-28
Electronic Structure Of Alloys Surfaces And Clusters written by Abhijit Mookerjee and has been published by CRC Press this book supported file pdf, txt, epub, kindle and other format this book has been release on 2002-11-28 with Technology & Engineering categories.
Understanding the electronic structure of solids is a basic part of theoretical investigation in physics. Application of investigative techniques requires the solid under investigation to be "periodic." However, this is not always the case. This volume addresses three classes of "non-periodic" solids currently undergoing the most study: alloys, surfaces and clusters. Understanding the electronic structure of these systems is fundamental not only for the basic science, but also constitutes a very important step in various technological aspects, such as tuning their stabilities, chemical and catalytic reactivities and magnetism. Expert practitioners give an up-to-date account of the field with enough detailed background so that even a newcomer can follow the development. The theoretical framework is discussed in addition to the present status of knowledge in the field. Electronic Structure of Alloys, Surfaces and Clusters also includes an extensive bibliography which provides a comprehensive reading list of work on the topic.
Lectures On Methods Of Electronic Structure Calculations
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Author : Vijay Kumar
language : en
Publisher: World Scientific Publishing Company Incorporated
Release Date : 1994
Lectures On Methods Of Electronic Structure Calculations written by Vijay Kumar and has been published by World Scientific Publishing Company Incorporated this book supported file pdf, txt, epub, kindle and other format this book has been release on 1994 with Science categories.
Atomic Structure Theory
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Author : Walter R. Johnson
language : en
Publisher: Springer Science & Business Media
Release Date : 2007-03-08
Atomic Structure Theory written by Walter R. Johnson and has been published by Springer Science & Business Media this book supported file pdf, txt, epub, kindle and other format this book has been release on 2007-03-08 with Science categories.
Atomic Structure Theory is a textbook for students with a background in quantum mechanics. The text is designed to give hands-on experience with atomic structure calculations. Material covered includes angular momentum methods, the central field Schrödinger and Dirac equations, Hartree-Fock and Dirac-Hartree-Fock equations, multiplet structure, hyperfine structure, the isotope shift, dipole and multipole transitions, basic many-body perturbation theory, configuration interaction, and correlation corrections to matrix elements. Numerical methods for solving the Schrödinger and Dirac eigenvalue problems and the (Dirac)-Hartree-Fock equations are given as well. B-spline basis sets are used to carry out sums arising in higher-order many-body calculations. Illustrative problems are provided, together with solutions. FORTRAN programs implementing the numerical methods in the text are included.
Computational Quantum Mechanics For Materials Engineers
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Author : Levente Vitos
language : en
Publisher: Springer Science & Business Media
Release Date : 2007-08-10
Computational Quantum Mechanics For Materials Engineers written by Levente Vitos and has been published by Springer Science & Business Media this book supported file pdf, txt, epub, kindle and other format this book has been release on 2007-08-10 with Technology & Engineering categories.
This is the only book to cover the most recent developments in applied quantum theory and their use in modeling materials properties. It describes new approaches to modeling disordered alloys and focuses on those approaches that combine the most efficient quantum-level theories of random alloys with the most sophisticated numerical techniques. In doing so, it establishes a theoretical insight into the electronic structure of complex materials such as stainless steels, Hume-Rothery alloys and silicates.
Frontiers In Materials Modelling And Design
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Author : Vijay Kumar
language : en
Publisher: Springer Science & Business Media
Release Date : 2012-12-06
Frontiers In Materials Modelling And Design written by Vijay Kumar and has been published by Springer Science & Business Media this book supported file pdf, txt, epub, kindle and other format this book has been release on 2012-12-06 with Science categories.
It is about fifteen years since we started hearing about Computational Ma terials Science and Materials Modelling and Design. Fifteen years is a long time and all of us realise that the use of computational methods in the design of materials has not been rapid enough. We also know the reasons for this. Mate rials properties are not dependent on a single phenomenon. The properties of materials cover a wide range from electronic, thermal, mechanical to chemical and electro-chemical. Each of these class of properties depend on specific phe nomenon that takes place at different scales or levels of length from sub atomic to visible length levels. The energies controlling the phenomena also varies widely from a fraction of an electron volt to many joules. The complexity of materials are such that while models and methods for treating individual phenomenon have been perfected, incorporating them into a single programme taking into account the synergism is a formidable task. Two specific areas where the progress has been very rapid and substantive are prediction of phase stability and phase diagrams and embrittlement of steels by metalloids. The first three sections of the book contain papers which review the theoreti cal principles underlying materials modeling and simulations and show how they can be applied to the problems just mentioned. There is now a strong interest in designing new materials starting from nanoparticles and clusters.
Carbon Alloys
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Author : E. Yasuda
language : en
Publisher: Elsevier
Release Date : 2003
Carbon Alloys written by E. Yasuda and has been published by Elsevier this book supported file pdf, txt, epub, kindle and other format this book has been release on 2003 with Science categories.
In recent years the Japanese have funded a comprehensive study of carbon materials which incorporate other elements including boron, nitrogen and fluorine, hence the title of the project "Carbon Alloys". Coined in 1992, the phrase "Carbon Alloys" can be applied to those materials mainly composed of carbon materials in multi-component systems. The carbon atoms of each component have a physical and/or chemical interactive relationship with other atoms or compounds. The carbon atoms of the components may have different hybrid bonding orbitals to create quite different carbon components. Eiichi Yasuda and his team consider the definition of Carbon Alloys, present the results of the Carbon Alloys projects, describe typical Carbon Alloys and their uses, discuss recent techniques for their characterization, and finally, illustrate potential applications and future developments for Carbon Alloy science. The book contains over thirty chapters on these studies from as many researchers. The most modern of techniques, particularly in the area of spectroscopy, were used as diagnostic tools, and many of these are applicable to pure carbons also. Porosity in carbons received considerable attention.
Conformal Field Theory
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Author : Yavuz Nutku
language : en
Publisher: CRC Press
Release Date : 2018-03-14
Conformal Field Theory written by Yavuz Nutku and has been published by CRC Press this book supported file pdf, txt, epub, kindle and other format this book has been release on 2018-03-14 with Science categories.
This book provides an understanding of conformal field theory and its importance to both statistical mechanics and string theory. It introduces the Wess-Zumino-Novokov-Witten (WZNW) models and their current algebras, the affine Kac-Moody algebras.
Statistical Plasma Physics Volume I
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Author : Setsuo Ichimaru
language : en
Publisher: CRC Press
Release Date : 2018-05-04
Statistical Plasma Physics Volume I written by Setsuo Ichimaru and has been published by CRC Press this book supported file pdf, txt, epub, kindle and other format this book has been release on 2018-05-04 with Science categories.
Plasma physics is an integral part of statistical physics, complete with its own basic theories. Designed as a two-volume set, Statistical Plasma Physics is intended for advanced undergraduate and beginning graduate courses on plasma and statistical physics, and as such, its presentation is self-contained and should be read without difficulty by those with backgrounds in classical mechanics, electricity and magnetism, quantum mechanics, and statistics. Major topics include: plasma phenomena in nature, kinetic equations, plasmas and dielectric media, electromagnetic properties of Vlasov plasmas in thermodynamic equilibria, transient processes, and instabilities.
Introduction To Ultrahigh Energy Cosmic Ray Physics
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Author : Pierre Sokolsky
language : en
Publisher: CRC Press
Release Date : 2018-03-08
Introduction To Ultrahigh Energy Cosmic Ray Physics written by Pierre Sokolsky and has been published by CRC Press this book supported file pdf, txt, epub, kindle and other format this book has been release on 2018-03-08 with Science categories.
Cosmic ray physics has recently attracted a great deal of attention from the high energy physics community because of the discovery of new sources and the advent of new techniques. The result of a series of lectures prepared for graduate students and postdoctoral researchers, this book is a general introduction to experimental techniques and results in the field of ultrahigh energy cosmic rays. It succinctly summarizes the rapidly developing field, and provides modern results that include data from newer detectors. Combining experiment and theory, the text explores the results of a single, easy-to-understand experiment to tie together various issues involved in the physics of ultrahigh energy cosmic rays.