Topics in the theory of amorphous materials

被引:116
作者
Drabold, D. A. [1 ,2 ]
机构
[1] Trinity Coll, Cambridge CB2 1TQ, England
[2] Ohio Univ, Dept Phys & Astron, Athens, OH 45701 USA
关键词
BINDING MOLECULAR-DYNAMICS; TOTAL-ENERGY CALCULATIONS; ELECTRONIC-STRUCTURE; IONIC-CONDUCTIVITY; STRUCTURAL MODELS; WANNIER FUNCTIONS; ANDERSON LOCALIZATION; DISORDERED MATERIALS; NEUTRON-SCATTERING; SIMULATION;
D O I
10.1140/epjb/e2009-00080-0
中图分类号
O469 [凝聚态物理学];
学科分类号
070205 ;
摘要
In this Colloquium, I describe some current frontiers in the physics of semiconducting amorphous materials and glasses, including a short, but self-contained discussion of techniques for creating computer models, among them the quench from the melt method, the Activation-Relaxation Technique, the decorate and relax method, and the experimentally constrained molecular relaxation scheme. A representative study of an interesting and important glass (amorphous GeSe3:Ag) is provided. This material is a fast-ion conductor and a serious candidate to replace current FLASH memory. Next, I discuss the effects of topological disorder on electronic states. By computing the decay of the density matrix in real space, and also computing well-localized Wannier functions, we close with a quantitative discussion of Kohn's Principle of Nearsightedness in amorphous silicon.
引用
收藏
页码:1 / 21
页数:21
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