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A chemical model of Frenkel defects in fluorite
Journal article

A chemical model of Frenkel defects in fluorite

Abstract

A technique based on the empirical properties of chemical bonds is used to model Frenkel defects in fluorite. It can identify likely positions for the interstitial F ion and, by predicting the ideal defect geometry from the resulting chemical bond network, it predicts a relaxed defect geometry which agrees with both neutron scattering measurements and the geometries predicted by other methods.

Authors

Brown ID

Journal

Solid State Ionics, Vol. 31, No. 3, pp. 203–208

Publisher

Elsevier

Publication Date

January 1, 1988

DOI

10.1016/0167-2738(88)90269-x

ISSN

0167-2738

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