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Coulomb correlations in semiconductors

  • Worcester Polytechnic Institute
  • Stanford University

Research output: Contribution to journalArticlepeer-review

2 Citations (Scopus)

Abstract

We use tight-binding theory to demonstrate how (formula presented) theory and local-density approximation (LDA) energies should be corrected to incorporate Coulomb correlation corrections. Applications to the enhanced band gap for the creation of quasiparticles, to the effective mass of carriers, and to the static dielectric susceptibility are given. We find that, in the (formula presented) calculations of effective masses, use of the enhanced gap is only accurate for small-gap semiconductors. In the expression for the static dielectric constant, one should use the unenhanced LDA gap for the leading term and the enhanced gap for the metallization term.

Original languageEnglish
Article number235211
Pages (from-to)2352111-2352116
Number of pages6
JournalPhysical Review B - Condensed Matter and Materials Physics
Volume66
Issue number23
DOIs
Publication statusPublished - 2002
Externally publishedYes

OECD Field of Science

  • 1.3 Physical Sciences

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