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The electronic properties of tetrahedral intermetallic compounds I. Charge distribution

Coulson, Charles Alfred, Rèdei, L. B., Stocker, D.·1962·Proceedings of the Royal Society of London. Series A. Mathematical and Physical Sciences

Abstract

A discussion is commenced in which the electronic properties of tetrahedral intermetallic compounds are described in terms of localized molecular-orbital bonds. The correct definitions of covalency and polarity of these bonds are linked with the netionicity of the atoms of the crystal. Detailed non-empirical calculations of boron nitride provide a description of the bonds, and associated formal charges. An alternative simple but partially self-consistent analysis is presented whereby the coefficients in the simple molecular-orbital description may be found semi-empirically. The charges thus predicted agree well with those calculated by the earlier non-empirical method, and also with such experimental values as are available.

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Metadata

Authors
Coulson, C. A., Rèdei, L. B., & Stocker, D.
Venue
Proceedings of the Royal Society of London. Series A. Mathematical and Physical Sciences
Published
1962-11-27
Volume
270
Issue
1342
Pages
357-372
ISSN
  • 0080-4630 (ISSN-L)
  • 2053-9169
OpenAlex
W2051844798
Cited by
201
References
0
FWCI
1.85
Type
journal article
Language
en
Open access
closed

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CoChat. (2026). Citation check: The electronic properties of tetrahedral intermetallic compounds I. Charge distribution. https://app.cochat.ai/papers/10.1098/rspa.1962.0229
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Coulson, C. A., Rèdei, L. B., & Stocker, D. (1962). The electronic properties of tetrahedral intermetallic compounds I. Charge distribution. Proceedings of the Royal Society of London. Series A. Mathematical and Physical Sciences. https://doi.org/10.1098/rspa.1962.0229

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