QUANTUM DIELECTRIC THEORY OF ELECTRONEGATIVITY IN COVALENT SYSTEMS .I. ELECTRONIC DIELECTRIC CONSTANT

被引:1156
作者
VANVECHTEN, JA
机构
[1] Department of Physics, University of Chicago, Chicago
[2] Bell Telephone Laboratories, Murray Hill, NJ
来源
PHYSICAL REVIEW | 1969年 / 182卷 / 03期
关键词
D O I
10.1103/PhysRev.182.891
中图分类号
O4 [物理学];
学科分类号
0702 ;
摘要
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. © 1969 The American Physical Society.
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页码:891 / +
页数:1
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