Topology of amorphous tetrahedral semiconductors on intermediate length scales

被引:55
作者
Mousseau, N [1 ]
Lewis, LJ [1 ]
机构
[1] UNIV MONTREAL,GRP RECH PHYS & TECHNOL COUCHES MINCES,MONTREAL,PQ H3C 3J7,CANADA
关键词
D O I
10.1103/PhysRevLett.78.1484
中图分类号
O4 [物理学];
学科分类号
0702 ;
摘要
Using the recently proposed ''activation-relaxation technique,'' we develop a structural model for a-GaAs almost free of odd-membered rings, i.e., wrong bonds, having an almost perfect coordination of four. This model is found to be superior to structures from tight-binding or quantum molecular dynamics simulations. Comparing with a-Si, as described by a Polk-type continuous random network, we find that the cost of wrong bonds is such that the two materials should have different topologies. Our study provides direct information on the intermediate-range topology of amorphous tetrahedral semiconductors.
引用
收藏
页码:1484 / 1487
页数:4
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