Title of article
Contributions from the indirect ionic interactions to the elastic constants in the rock-salt structure crystals
Author/Authors
Itsuki، نويسنده , , Kazuya and Michihiro، نويسنده , , Yoshitaka and Endou، نويسنده , , Shigeki and Nakamura، نويسنده , , Koichi and Ohno، نويسنده , , Takashi، نويسنده ,
Issue Information
هفته نامه با شماره پیاپی سال 2009
Pages
5
From page
917
To page
921
Abstract
Under the harmonic approximation, the contributions from the indirect ionic interactions to the elastic constants are calculated for the alkali halide and silver halide crystals with the rock-salt structure. The coupling constants of the indirect ionic interactions are calculated by the self-consistent field treatment of the local density approximation and the spherical solid model. The calculated values of the coupling constants are large for the silver ion. The indirect ionic interaction significantly affects the elastic constants. It quantitatively explains the deviation from the Cauchy relation in alkali halide crystals. Moreover, it provides a clear account for the large values of the deviation from the Cauchy relation in AgCl and AgBr.
Keywords
Elastic constant , Deviation from the Cauchy relation , Indirect ionic interaction , Self-consistent field treatment of the local density approximation , Rock-salt structure crystal
Journal title
Solid State Ionics
Serial Year
2009
Journal title
Solid State Ionics
Record number
1721379
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