Electronic Structure: Basic Theory and Practical Methods

Martin, Richard M

Electronic Structure: Basic Theory and Practical Methods - United Kingdom: Cambridge University Press, 2020 - viii, 762 p,

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

 9781108429900


Electronic structure
Structure électronique

530.411 / MAR/E
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