Lattice polarization effects on the screened Coulomb interaction W of the GW approximation

Walter R. L. Lambrecht, Churna Bhandari, and Mark van Schilfgaarde
Phys. Rev. Materials 1, 043802 – Published 19 September 2017

Abstract

In polar insulators where longitudinal and transverse optical phonon modes differ substantially, the electron-phonon coupling affects the energy-band structure primarily through the long-range Fröhlich contribution to the Fan term. This diagram has the same structure as the GW self-energy where W originates from the electron part of the screened Coulomb interaction. The two can be conveniently combined by combining electron and lattice contributions to the polarizability. Both contributions are nonanalytic at the origin, and diverge as 1/q2 so that the predominant contribution comes from a small region around q=0. Here we adopt a simple estimate for the Fröhlich contribution by assuming that the entire phonon part can be attributed to a small volume of q near q=0. We estimate the magnitude for q0 from a generalized Lyddane-Sachs-Teller relation, and the radius from the inverse of the polaron length scale. The gap correction is shown to agree with Fröhlich's simple estimate αPωLO/2 of the polaron effect with αP the polaron coupling factor.

  • Figure
  • Received 29 June 2017
  • Revised 7 August 2017

DOI:https://doi.org/10.1103/PhysRevMaterials.1.043802

©2017 American Physical Society

Physics Subject Headings (PhySH)

  1. Techniques
Condensed Matter, Materials & Applied Physics

Authors & Affiliations

Walter R. L. Lambrecht

  • Department of Physics, Case Western Reserve University, 10900 Euclid Avenue, Cleveland, Ohio 44106-7079, USA

Churna Bhandari

  • Department of Physics, University of Missouri, Columbia, Missouri 65211, USA

Mark van Schilfgaarde

  • Department of Physics, King's College London, London WC2R 2LS, United Kingdom

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Issue

Vol. 1, Iss. 4 — September 2017

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