GWΓ approximation for electron self-energies in semiconductors and insulators

R. Del Sole, Lucia Reining, and R. W. Godby
Phys. Rev. B 49, 8024 – Published 15 March 1994
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Abstract

The widely used GW approximation for the self-energy operator of a system of interacting electrons may, in principle, be improved using an approximate vertex correction Γ. We estimate Γ using the local-density approximation. We report the results of a comparable series of GW calculations for the band structure of silicon, in which such a vertex correction is (i) excluded entirely, (ii) included only in the screened Coulomb interaction W, and (iii) included in both W and the expression for the self-energy. We also discuss the symmetry properties of the exact vertex correction and how they may be retained in further improvements.

  • Received 12 July 1993

DOI:https://doi.org/10.1103/PhysRevB.49.8024

©1994 American Physical Society

Authors & Affiliations

R. Del Sole

  • Centre Européen de Calcul Atomique et Moléculaire, Université Paris-Sud, Bâtiment 506, Orsay, France
  • Dipartimento di Fisica, Università di Roma ‘‘Tor Vergata,’’ via della Ricerca Scientifica 1, I-00133 Roma, Italy

Lucia Reining

  • Laboratoire des Solides Irradiés, Commisariat à l’Energie Atomique, Unité de Recherche Associée 1380, Ecole Polytechnique, 91128 Palaiseau, France
  • Centre Européen de Calcul Atomique et Moléculaire, Université Paris-Sud, Bâtiment 506, Orsay, France

R. W. Godby

  • Cavendish Laboratory, University of Cambridge, Madingley Road, Cambridge CB3 0HE, United Kingdom

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Vol. 49, Iss. 12 — 15 March 1994

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