Electronic Density Functional Theory

Table of Contents

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   Book Overview
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   Chapter 1 Brief Introduction to Density Functional Theory
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   Chapter 2 Digging into the Exchange-Correlation Energy: The Exchange-Correlation Hole
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   Chapter 3 Driving out the Self-Interaction Error
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   Chapter 4 Time-Dependent Density-Functional Theory
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   Chapter 5 Mixing Exact Exchange with GGA: When to Say When
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   Chapter 6 Adiabatic Coupling in the Helium and the Beryllium Series
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   Chapter 7 Derivation of a Generalized Gradient Approximation: The PW91 Density Functional
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   Chapter 8 Correlation Energy in a High-Density Limit from Adiabatic Connection Perturbation Theory
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    Chapter 9 Calculating Electronic Energies from Kohn-Sham Effective Potentials
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    Chapter 10 A Correlation-Energy Functional for Addition to the Hartree-Fock Energy
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    Chapter 11 Relativistic Corrections to the Exchange-Correlation Energy Functional
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    Chapter 12 Are Unoccupied Kohn-Sham Eigenvalues Related to Excitation Energies?
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    Chapter 13 Time-Dependent Optimized Effective Potential in the Linear Response Regime
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    Chapter 14 Current-Density Functional Theory of Linear Response to Time-Dependent Electromagnetic Fields
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    Chapter 15 Effective Action in Density Functional Theory and the Berry Phase
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    Chapter 16 Hydrodynamics in the Thomas-Fermi-Dirac-von Weizsäcker Approximation
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    Chapter 17 Van der Waals Interactions in Density Functional Theory
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    Chapter 18 Van der Waals Functionals via Local Approximations for Susceptibilities
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    Chapter 19 Bound-Free Correlation Potentials for Scattering Theory
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    Chapter 20 Edge Electronic Structure: The Airy Gas
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    Chapter 21 Density Functionals for Energies and Eigenvalues: Local Mass Approximation
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    Chapter 22 Ensemble Density Functional Theory for Inhomogeneous Fractional Quantum Hall Systems
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    Chapter 23 Applications of Self-Interaction Corrections to Localized States in Solids
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    Chapter 24 Density Functional Calculations for Molecules and Clusters — Li n , Li n O, C n
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    Chapter 25 A Functional Theory of Interacting Local Spins, Spin Polarized Electrons, and Ions: Half Metallic Magnets
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    Chapter 26 Density Functional Theory of Super-Phenomena in Condensed Systems
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    Chapter 27 Ab Initio Calculations of Magnetic Interactions in Magnetic Metal Alloys via the LSDF Approach
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    Chapter 28 UNICHEM and Electron Momentum Spectroscopy Investigation into the Valence Electronic Structure of trans 1,3 Butadiene
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    Chapter 29 Van der Waals Interactions in Density Functional Theory
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    Chapter 30 Quantitative Electron Momentum Spectroscopy of Solids