Focus Session: Fundamental Developments in Density Functional Theory II

Presentations

• Phase-Space Explorations in Time-Dependent Density Functional Theory

  COFFEE_KLATCH · Invited

  March 16, 2009, 11:15 AM – March 16, 2009, 11:51 AM

  Authors

  • Neepa Maitra

    • Hunter College and the Graduate Center of the City University of New York

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• Time-dependent density-functional theory for electronic excitations in materials

  COFFEE_KLATCH · Invited

  March 16, 2009, 11:51 AM – March 16, 2009, 12:27 PM

  Authors

  • Carsten A. Ullrich

    • University of Missouri

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• Many-Pole Self-Energy Model Corrections to Kohn-Sham Calculations of Excited State Spectra

  ORAL

  March 16, 2009, 12:27 PM – March 16, 2009, 12:39 PM

  Authors

  • J. J. Kas

    • University of Washington

  • M. Prange

    • University of Washington

  • J. J. Rehr

    • University of Washington

  • H. M. Lawler

    • University of Washington

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• First principle calculations of long range correlation effects within the random phase approximation

  ORAL

  March 16, 2009, 12:39 PM – March 16, 2009, 12:51 PM

  Authors

  • Deyu Lu

  • Yan Li

  • Hugh Wilson

  • Giulia Galli

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• Tailoring High-Order Harmonics: A Computational Approach Based on Time-Dependent Density-Functional Theory

  ORAL

  March 16, 2009, 12:51 PM – March 16, 2009, 1:03 PM

  Authors

  • Alberto Castro

    • Institut fur Theoretisch Physik, Freie Universitat Berlin
    • Free University of Berlin
    • Department of Physics, Free University of Berlin

  • Ali Akbari

    • Universidad del Pais Vasco

  • Angel Rubio

    • ETSF, Universidad del Pa\'is Vasco, Spain
    • Universidad del Pais Vasco

  • Eberhard Gross

    • Institut f{\"u}r Theoretische Physik, Freie Universit{\"a}t Berlin, Germany and European Theoretical Spectroscopy Facility (ETSF)
    • Department of Physiks, Free University of Berlin

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• Ab initio calculations of optical spectra by solving the Bethe-Salpeter equation without empty states.Work

  ORAL

  March 16, 2009, 1:03 PM – March 16, 2009, 1:15 PM

  Authors

  • Dario Rocca

    • UC Davis
    • University of California, Davis

  • Deyu Lu

    • University of California, Davis

  • Giulia Galli

    • UC Davis
    • University of California Davis
    • Department of Chemistry, University of California, Davis
    • UC Davis, Chemistry Department, Davis CA
    • University of California, Davis

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• Time-dependent transition densities

  ORAL

  March 16, 2009, 1:15 PM – March 16, 2009, 1:27 PM

  Authors

  • Yonghui Li

    • University of Missouri

  • Carsten A. Ullrich

    • University of Missouri

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• Is the Kohn-Sham Oscillator Strength Exact at the Ionization Threshold?

  ORAL

  March 16, 2009, 1:27 PM – March 16, 2009, 1:39 PM

  Authors

  • Zenghui Yang

    • University of California, Irvine, CA 92697, USA

  • Meta van Faassen

    • Afdeling Theoretische Chemie, Vrije Universiteit, De Boelelaan 1083, 1081 HV Amsterdam, Kingdom of the Netherlands

  • Kieron Burke

    • University of California, Irvine
    • Department of Chemistry - UC-Irvine
    • University of California, Irvine, CA 92697, USA
    • Department of Chemistry, University of California, Irvine
    • Department of chemistry and physics, University of California, Irvine

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• An Exact Condition for the Integrand of Adiabatic Connection

  ORAL

  March 16, 2009, 1:39 PM – March 16, 2009, 1:51 PM

  Authors

  • Zhenfei Liu

    • University of California, Irvine

  • Kieron Burke

    • University of California, Irvine
    • Department of Chemistry - UC-Irvine
    • University of California, Irvine, CA 92697, USA
    • Department of Chemistry, University of California, Irvine
    • Department of chemistry and physics, University of California, Irvine

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• New exact and approximate forms for the Luttinger-Ward correlation energy functional within the GW-RPA approximation

  ORAL

  March 16, 2009, 1:51 PM – March 16, 2009, 2:03 PM

  Authors

  • Sohrab Ismail-Beigi

    • Yale, CRISP
    • Department of Physics, Yale University
    • Yale University
    • Department of Applied Physics, Yale University
    • Department of Applied Physics and Physics and Center for Research on Interface Structures and Phenomena (CRISP), Yale University

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• Non-empirical hyper-generalized-gradient functionals constructed from the Lieb-Oxford bound

  ORAL

  March 16, 2009, 2:03 PM – March 16, 2009, 2:15 PM

  Authors

  • Mariana M. Odashima

    • Universidade de Sao Paulo

  • Klaus Capelle

    • University of Sao Paulo, Brazil
    • Universidade de Sao Paulo

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