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[share_ebook] Full-Potential Electronic Structure Method


作者: John M. Wills, Mebarek Alouani, Per Andersson, Anna Delin, Olle Eriksson, Oleksiy Grechnyev

日期: 2010-12-02

ISBN: 3642151434

页数: 212

语言: English

出版社: Springer

标签: 物理



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share_ebook Full Potential Electronic Structure Method
Title:Full-Potential Electronic Structure Method
Author:John M. Wills, Mebarek Alouani, Per Andersson, Anna Delin, Olle Eriksson, Oleksiy Grechnyev
Publisher:Springer
ISBN:3642151434
ISBN13:
Date2010-12-02
Pages:212
Language:English
Format: PDF
Size:3.75 MB

Description: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 local spin density approximation, generalised gradient approximation, self-interaction correction and dynamical mean field theory.


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