Free download Electronic Structure: Basic Theory and Practical Methods (2nd edition) written by Richard M. Martin in pdf.
According to the author, “The study of the electronic structure of materials is at a momentous stage, with new computational methods and advances in basic theory. Many properties of materials can be determined from the fundamental equations, and electronic structure theory is now an integral part of research in physics, chemistry, materials science, and other fields. This book provides a unified exposition of the theory and methods, with emphasis on understanding each essential component.
New in the second edition are recent advances in density functional theory, an introduction to Berry phases and topological insulators explained in terms of elementary band theory, and many new examples of applications.
Graduate students and research scientists will find careful explanations with references to original papers, pertinent reviews, and accessible books. Each chapter includes a short list of the most relevant works and exercises that reveal salient points and challenge the reader.”
Contents
Part I: Overview and Background Topics
- Introduction
- Overview
- Theoretical Background
- Periodic Solids and Electron Bands
- Uniform Electron Gas and sp-Bonded Metals
Part II: Density Functional Theory
- Density Functional Theory: Foundations
- The Kohn–Sham Auxiliary System
- Functionals for Exchange and Correlation I
- Functionals for Exchange and Correlation II
Part III: Important Preliminaries on Atoms
- Electronic Structure of Atoms
- Pseudopotentials
Part IV: Determination of Electronic Structure: The Basic Methods
- Plane Waves and Grids: Basics
- Plane Waves and Real-Space Methods: Full Calculations
- Localized Orbitals: Tight-Binding
- Localized Orbitals: Full Calculations
- Augmented Functions: APW, KKR, MTO
- Augmented Functions: Linear Methods
- Locality and Linear-Scaling O(N) Methods
Part V: From Electronic Structure to Properties of Matter
- Quantum Molecular Dynamics (QMD)
- Response Functions: Phonons and Magnons
- Excitation Spectra and Optical Properties
- Surfaces, Interfaces, and Lower-Dimensional Systems
- Wannier Functions
- Polarization, Localization, and Berry Phases
Part VI: Electronic Structure and Topology
- Topology of the Electronic Structure of a Crystal: Introduction
- Two-Band Models: Berry Phase, Winding, and Topology
- Topological Insulators I: Two Dimensions
- Topological Insulators II: Three Dimensions
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