A shell-model analysis of the structure and dynamics of crystal edges of alkali halides

被引:0
|
作者
Bonart, D
机构
[1] Inst. für Theoretische Physik, Universität Regensburg
关键词
D O I
10.1088/0953-8984/8/27/002
中图分类号
O469 [凝聚态物理学];
学科分类号
070205 ;
摘要
The static relaxation and the lattice dynamics of rectangular edges of quadratic bars of four rock-salt-structured alkali halides is calculated using a shell model. The relaxation includes a large-scale contraction of the bar as well as tip-localized microscopic static displacements. The phonon spectra of relaxed quadratic bars are presented and modes localized at the edges are identified.
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页码:4881 / 4888
页数:8
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