Electronic Structure, Dynamics, and Quantum Structural Properties of Condensed Matter

Electronic Structure, Dynamics, and Quantum Structural Properties of Condensed Matter PDF

Author: Jozef T. Devreese

Publisher: Springer Science & Business Media

Published: 2013-11-21

Total Pages: 591

ISBN-13: 1475708998

DOWNLOAD EBOOK →

The 1984 Advanced Study Institute on "Electronic Structure, Dynamics and Quantum Structural Properties of Condensed Matter" took place at the Corsendonk Conference Center, close to the City of Antwerpen, from July 16 till 27, 1984. This NATO Advanced Study Institute was motivated by the research in my Institute, where, in 1971, a project was started on "ab-initio" phonon calculations in Silicon. I~ is my pleasure to thank several instances and people who made this ASI possible. First of all, the sponsor of the Institute, the NATO Scientific Committee. Next, the co-sponsors: Agfa-Gevaert, Bell Telephone Mfg. Co. N.V., C & A, Esso Belgium·, CDC Belgium, Janssens Pharmaceutica, Kredietbank and the Scientific Office of the U.S. Army. Special thanks are due to Dr. P. Van Camp and Drs. H. Nachtegaele, who, over several months, prepared the practical aspects of the ASI with the secretarial help of Mrs. R.-M. Vandekerkhof. I also like to. thank Mrs. M. Cuyvers who prepared and organized the subject and material index and Mrs. H. Evans for typing-assist ance. I express particular gratitude to Mrs. F. Nedee, who, like in 1981 and 1982, has put the magnificent Corsendonk Conference Center at our disposal and to Mr. D. Van Der Brempt, Director of the Corsendonk Conference Center, for the efficient way in which he and his staff took care of the practical organization at the Conference Center.

Computational Methods in Condensed Matter: Electronic Structure

Computational Methods in Condensed Matter: Electronic Structure PDF

Author: A.A. Katsnelson

Publisher: Springer Science & Business Media

Published: 1992-03-02

Total Pages: 220

ISBN-13: 9780883188651

DOWNLOAD EBOOK →

"Blurb & Contents" This current and comprehensive treatment of the physics of small- amplitude waves in hot magnetized plasmas provides a thorough update of the author's classic Theory of Plasma Waves. New topics include quasi-linear theory, inhomogeneous plasmas, collisions, absolute and convective instability, and mode conversion. Valuable for graduates and advanced undergraduates and an indispensable reference work for researchers in plasmas, controlled fusion, and space science.

Computer Simulations Of Molecules And Condensed Matter: From Electronic Structures To Molecular Dynamics

Computer Simulations Of Molecules And Condensed Matter: From Electronic Structures To Molecular Dynamics PDF

Author: Wang Enge

Publisher: World Scientific

Published: 2018-01-17

Total Pages: 280

ISBN-13: 9813230460

DOWNLOAD EBOOK →

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. Contents: Introduction to Computer Simulations of Molecules and Condensed MatterQuantum Chemistry Methods and Density-Functional TheoryPseudopotentials, Full Potential, and Basis SetsMany-Body Green's Function Theory and the GW ApproximationMolecular DynamicsExtension of Molecular Dynamics, Enhanced Sampling and the Free-Energy CalculationsQuantum Nuclear EffectsAppendices: Useful Mathematical RelationsExpansion of a Non-Local FunctionThe Brillouin-Zone IntegrationThe Frequency IntegrationReferencesAcknowledgements Readership: Researchers in computational condensed matter physics. Keywords: Electronic Structures;First-Principle;Molecular Dynamics;Path-IntegralReview: Key Features: Elaboration on a framework of concepts based on the authors' research experiencesIllustrations of methods ranging from electronic structures to molecular dynamicsDetailed explanation of the path-integral method

Quantum Theory of Real Materials

Quantum Theory of Real Materials PDF

Author: James R. Chelikowsky

Publisher: Springer Science & Business Media

Published: 1996-02-29

Total Pages: 580

ISBN-13: 9780792396666

DOWNLOAD EBOOK →

A Festschrift in honor of Professor Marvin L. Cohen This volume is a Festschrift in honor of Professor Marvin L. Cohen. The articles, contributed by leading researchers in condensed matter physics, high-light recent advances in the use of quantum theory to explain and predict properties of real materials. The invention of quantum mechanics in the 1920's provided detailed descriptions of the electronic structure of atoms. However, a similar understanding of solids has been achieved only in the past 30 years, owing to the complex electron-ion and electron electron interactions in these systems. Professor Cohen is a central figure in this achievement. His development of the pseudopotential and total energy methods provided an alternate route using computers for the exploration of solids and new materials even when they have not yet been synthesized. Professor Cohen's contributions to materials theory have been both fundamental and encompassing. The corpus of his work consists of over 500 papers and a textbook. His band structures for semiconductors are used worldwide by researchers in solid state physics and chemistry and by device engineers. Professor Cohen's own use of his theories has resulted in the determination of the electronic structure, optical properties, structural and vibrational properties, and superconducting properties of numerous condensed matter systems including semiconductors, metals, surfaces, interfaces, defects in solids, clusters, and novel materials such as the fullerides and nanotubes.

Electronic Structure

Electronic Structure PDF

Author: Richard M. Martin

Publisher: Cambridge University Press

Published: 2004-04-08

Total Pages: 658

ISBN-13: 9780521782852

DOWNLOAD EBOOK →

An important graduate textbook in condensed matter physics by highly regarded physicist.

Lectures On Methods Of Electronic Structure Calculations - Proceedings Of The Miniworkshop On "Methods Of Electronic Structure Calculations" And Working Group On "Disordered Alloys"

Lectures On Methods Of Electronic Structure Calculations - Proceedings Of The Miniworkshop On

Author: Ole Krogh Andersen

Publisher: World Scientific

Published: 1995-02-23

Total Pages: 396

ISBN-13: 9814583278

DOWNLOAD EBOOK →

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.

Quantum Simulations Of Condensed Matter Phenomena - International Workshop

Quantum Simulations Of Condensed Matter Phenomena - International Workshop PDF

Author: James E Gubernatis

Publisher: World Scientific

Published: 1989-12-01

Total Pages: 454

ISBN-13: 9813108304

DOWNLOAD EBOOK →

The purpose of this workshop is to present and exchange information on rapidly growing areas in physics and chemistry where quantum simulation techniques are being developed and applied to the study of a variety of condensed matter phenomena. These techniques include, but are not limited to zero and finite temperature many-electron Monte Carlo methods, quantum spin systems techniques, variational and Green's function Monte Carlo methods, exact diagonalization studies of small clusters, and studies of real-time quantum dynamics by path-integral and related approaches.