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Time-dependent exciton wave functions from TDDFT

ORAL

Abstract

Time-dependent density-functional theory (TDDFT) is a computationally efficient alternative to the Bethe-Salpeter equation for calculating optical spectra in insulators and semiconductors, including excitonic effects. We show how time-dependent exciton wave functions can be obtained from TDDFT via the time-dependent Kohn-Sham transition density matrix. The method is illustrated using one-dimensional model solids.

Presenters

  • Jared R. Williams

    Physics and Astronomy, Univ of Missouri - Columbia

Authors

  • Jared R. Williams

    Physics and Astronomy, Univ of Missouri - Columbia

  • Carsten A. Ullrich

    Univ of Missouri - Columbia, Physics and Astronomy, Univ of Missouri - Columbia, Department of Physics and Astronomy, University of Missouri, Columbia, Missouri 65211, USA