Quantum Dielectric Theory of Electronegativity in Covalent Systems. I. Electronic Dielectric Constant

J. A. Van Vechten
Phys. Rev. 182, 891 – Published 15 June 1969
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Abstract

Electronegativity difference is redefined as a scaling parameter, generalizing the concept of valence difference. A procedure for its evaluation is developed in terms of the dielectric constants of diatomic crystals. A simple alternative to the Clausius-Mossotti theory of the electronic dielectric constant is developed in terms of this concept. The effect of d-electron states and of hydrostatic pressure are discussed, and procedures for their approximate evaluation are developed. The treatment is extended to 68 crystals of the diamond, zincblende, wurtzite, and rock-salt types; values of the electronegativity parameter are tabulated for these crystals.

  • Received 6 January 1969

DOI:https://doi.org/10.1103/PhysRev.182.891

©1969 American Physical Society

Authors & Affiliations

J. A. Van Vechten*,†

  • Department of Physics, University of Chicago, Chicago, Illinois 60637

  • *Fannie and John Hertz Foundation Fellow.
  • Present address: Bell Telephone Laboratories, Murray Hill, N.J.

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Issue

Vol. 182, Iss. 3 — June 1969

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