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Electronic Structure: Basic Theory and Practical Methods

By: Martin, Richard M Publication details: United Kingdom: Cambridge University Press, 2020Description: viii, 762 pISBN: 9781108429900Subject(s): Electronic structure | Structure électroniqueDDC classification: 530.411

Contents:

1)Introduction 2)Overview 3)Theoretical background 4)Periodic solids and electron bands 5)Uniform electron gas and sp-bonded metals 5)Density functional theory : foundations 6)The Kohn-Sham auxiliary system 7)Functionals for exchange and correlation I 8)Functionals for exchange and correlation II 9)Electronic structure of atoms 10)Pseudopotentials 11)Plane waves and grids : basics 12)Plane waves and real space methods : full calculations 13)Localized orbitals : tight-binding 14)Localized orbitals : full calculations 15)Augmented functions : APW, KKR, MTO 16)Augmented functions : linear methods 17)Locality and linear scaling O(N) methods 18)Quantum molecular dynamics (QMD) 19)Response functions : phonons, magnons, .. 20)Excitation spectra and optical properties 21)Surfaces, interfaces, and lower dimensional systems 22)Wannier functions 23)Polarization, localization, and Berry phases 24)Topology of the electronic structure of a crystal : introduction 25)Two band models : Berry phase, winding and topology 26)Topological insulators I : two dimensions 27)Topological insulators II : three dimensions

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Holdings
Item type	Current library	Call number	Status	Date due	Barcode	Item holds
General Books	Central Library, Sikkim University General Book Section	530.411 MAR/E (Browse shelf(Opens below))	Available		053065

Total holds: 0

1)Introduction
2)Overview
3)Theoretical background
4)Periodic solids and electron bands
5)Uniform electron gas and sp-bonded metals
5)Density functional theory : foundations
6)The Kohn-Sham auxiliary system
7)Functionals for exchange and correlation I
8)Functionals for exchange and correlation II
9)Electronic structure of atoms
10)Pseudopotentials
11)Plane waves and grids : basics
12)Plane waves and real space methods : full calculations
13)Localized orbitals : tight-binding
14)Localized orbitals : full calculations
15)Augmented functions : APW, KKR, MTO
16)Augmented functions : linear methods
17)Locality and linear scaling O(N) methods
18)Quantum molecular dynamics (QMD)
19)Response functions : phonons, magnons, ..
20)Excitation spectra and optical properties
21)Surfaces, interfaces, and lower dimensional systems
22)Wannier functions
23)Polarization, localization, and Berry phases
24)Topology of the electronic structure of a crystal : introduction
25)Two band models : Berry phase, winding and topology
26)Topological insulators I : two dimensions
27)Topological insulators II : three dimensions

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