Book Volume 347 2014

First Principles Approaches to Spectroscopic Properties of Complex Materials

Editors:

ISBN: 978-3-642-55067-6 (Print) 978-3-642-55068-3 (Online)

Table of contents (9 chapters)

  1. Front Matter

    Pages i-xii

  2. No Access

    Chapter

    Pages 1-45

    Electronic and Optical Properties of Dye-Sensitized TiO2 Interfaces

  3. No Access

    Chapter

    Pages 47-98

    Status in Calculating Electronic Excited States in Transition Metal Oxides from First Principles

  4. No Access

    Chapter

    Pages 99-135

    Quasiparticle Self-Consistent GW Method for the Spectral Properties of Complex Materials

  5. No Access

    Chapter

    Pages 137-191

    Gas-Phase Valence-Electron Photoemission Spectroscopy Using Density Functional Theory

  6. No Access

    Chapter

    Pages 193-233

    Piecewise Linearity and Spectroscopic Properties from Koopmans-Compliant Functionals

  7. No Access

    Chapter

    Pages 235-257

    Optical Response of Extended Systems Using Time-Dependent Density Functional Theory

  8. No Access

    Chapter

    Pages 259-301

    Spin Excitations in Solids from Many-Body Perturbation Theory

  9. No Access

    Chapter

    Pages 303-345

    Dynamical Mean Field Theory-Based Electronic Structure Calculations for Correlated Materials

  10. No Access

    Chapter

    Pages 347-384

    Probing Strongly Correlated Materials in Non-equilibrium: Basic Concepts and Possible Future Trends in First Principle Approaches

  11. Back Matter

    Pages 385-392