Martin R., Electronic Structure - Basic Theory and Practical Methods

формат djvu
размер 9.46 МБ
добавлен 09 августа 2010 г.

Название: Martin R. , Electronic Structure - Basic Theory and Practical Methods
Издательство:Cambridge University Press
Год: 2004
ISBN-10: 0521782856

The study of the electronic structure of materials is at a momentous stage, with the emergence of new computational methods and theoretical approaches. This volume provides an introduction to the field and describes its conceptual framework, the capabilities of present methods, limitations, and challenges for the future. Many properties of materials can now be determined directly from the fundamental equations of quantum mechanics, bringing new insights into critical problems in physics, chemistry, and materials science.

Смотрите также

Alkauskas A., Deak P., Neugebauer J., Pasquarello A., Van de Walle Ch.G. (Eds.) Advanced Calculations for Defects in Materials: Electronic Structure Methods

формат pdf
размер 5.38 МБ
добавлен 15 октября 2011 г.

Wiley-VCH Verlag, 2011, 384 pages Defects and impurities are critically influencing the properties of materials. Increase in computing power and the development of efficient algorithms indicate a promising future for computational defect science. This book surveys recent advances in electronic structure methods. The application of hybrid functionals, the LDA+U method, time-dependent DFT, quantum Monte Carlo, and many-body perturbation theory ar...

Antonov V., et al. Electronic Structure and Magneto-optical Properties of Solids

формат djv
размер 3.52 МБ
добавлен 22 января 2011 г.

2004. – 528 р. The aim of this book is to review of recent achievements in the theoretical investigations of the electronic structure, optical, MO, and XMCD properties of compounds and multilayered structures. Chapter 1 of this book is of an introductory character and presents the theoretical foundations of the band theory of solids such as the density functional theory (DFT) for ground state properties of solids. Chapter 2 describes the MO prope...

Bersuker I.B. Electronic Structure and Properties of Transition Metal Compounds: Introduction to the Theory

формат pdf
размер 13.33 МБ
добавлен 11 января 2012 г.

Wiley; 2 edition, 2010, ISBN: 0470180234, 759 pages With more than 40% new and revised materials, this second edition offers researchers and students in the field a comprehensive understanding of fundamental molecular properties amidst cutting-edge applications. Including ~70 Example-Boxes and summary notes, questions, exercises, problem sets, and illustrations in each chapter, this publication is also suitable for use as a textbook for advance...

Horn K., Schefler M. (ed.) Handbook of Surface Science. Vol.2. Electronic Structure

формат djvu
размер 10 МБ
добавлен 19 января 2011 г.

Elsevier, 2000, 1058p. Fundamentals of the electronic structure of surfaces Electronic structure of semiconductor surfaces Electronic states on metal surfaces Electronic structure of adsorbates on surfaces. Adsorption on semiconductors. Theory of adsorption on metal substrates Experimental probes of the surface electronic structure Electronic structure of semiconductor surfaces Surface states on metal surfaces Magnetism at surfaces and in u...

Irene E.A. Electronic Materials Science

формат pdf
размер 4.65 МБ
добавлен 19 февраля 2011 г.

Wiley. 2005. 321 p. Introduction to Electronic Materials Science Structure of Solids Diffraction Defects in Solids Diffusion in Solids Phase Equilibria Mechanical Properties of Solids - Elasticity Mechanical Properties of Solids - Plasticity Electronic Structure of Solids Electronic Properties of Materials Junctions and Devices and the Nanoscale

Kiejna A., Wojciechowski K.F. Metal Surface Electron Physics

формат pdf
размер 10.81 МБ
добавлен 26 октября 2011 г.

Pergamon, Elsevier Science, 1996, 303 pages During the last thirty years metal surface physics, or generally surface science, has come a long way due to the development of vacuum technology and the new surface sensitive probes on the experimental side and new methods and powerful computational techniques on the theoretical side. The aim of this book is to introduce the reader to the essential theoretical aspects of the atomic and electronic str...

Kohanoff J. Electronic Structure Calculations for Solids and Molecules: Theory and Computational Methods

формат pdf
размер 15.07 МБ
добавлен 04 ноября 2011 г.

Cambridge University Press, 2006, Pages: 348 Electronic structure problems are studied in condensed matter physics and theoretical chemistry to provide important insights into the properties of matter. This 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 calc...

Louie S.G., Cohen M.L. Conceptual Foundations of Materials: A standard model for ground - and excited-state properties

формат pdf
размер 3.17 МБ
добавлен 30 октября 2011 г.

Elsеvier Sciеnce, 2006, 234 pages The goal of this Volume "Conceptual Foundations of Materials: A standard model for ground- and excited-state properties" is to present the fundamentals of electronic structure theory that are central to the understanding and prediction of materials phenomena and properties. The emphasis is on foundations and concepts. The Sections are designed to offer a broad and comprehensive perspective of the field. They co...

Unertl W.N.(ed.) Handbook of Surface Science. Vol.1. Physical Structure

формат pdf
размер 42.04 МБ
добавлен 24 января 2011 г.

Elsevier, 1996, 884 p. Basic aspects of the structure of crystalline surfaces Experimental methods to study surface structure Structure of adsorbed layers Defects and phase transitions at surfaces

Wills J.M., Eriksson O., Andersson P., Delin A., Alouani M., Grechnyev O. Full-Potential Electronic Structure Method: Energy and Force Calculations with Density Functional and Dynamical Mean Field Theory

формат pdf
размер 3.75 МБ
добавлен 04 ноября 2011 г.

Springer-Verlag Berlin, 2010, 197 pages This book covers the theory of electronic structure of materials, with special emphasis on the usage of linear muffin-tin orbitals. Methodological aspects are given in detail as are examples of the method when applied to various materials. Different exchange and correlation functionals are described and how they are implemented within the basis of linear muffin-tin orbitals. Functionals covered are the lo...