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γ-AuZn的结构与稳定性:金-锌体系中一种与γ-黄铜相关的复杂相

Structure and stability of γ-AuZn: a γ-brass-related complex phase in the Au-Zn System.

作者信息

Koley Biplab, Thimmaiah Srinivasa, Lidin Sven, Jana Partha P

机构信息

Department of Chemistry, Indian Institute of Technology Kharagpur, Kharagpur 721302, India.

Department of Chemistry, Iowa State University, and Ames Laboratory, U.S. Department of Energy, Iowa 50011, USA.

出版信息

Acta Crystallogr B Struct Sci Cryst Eng Mater. 2020 Dec 1;76(Pt 6):1109-1116. doi: 10.1107/S205252062001327X. Epub 2020 Nov 18.

DOI:10.1107/S205252062001327X
PMID:33289722
Abstract

γ-AuZn in the Au-Zn binary system has been synthesized and its structure analyzed by single-crystal X-ray diffraction. It crystallizes in the trigonal space group P31m (No. 157) with ∼227 atoms per unit cell and represents a \surd3a × \surd3a × c superstructure of rhombohedrally distorted γ-AuZn. The structure is largely tetrahedrally closed packed. The formation of γ-AuZn can be understood within the framework of a Hume-Rothery stabilization mechanism with a valence electron concentration of 1.68 e/a (valence electrons per atom).

摘要

在金-锌二元体系中合成了γ-AuZn,并通过单晶X射线衍射分析了其结构。它以三方空间群P31m(编号157)结晶,每个晶胞约有227个原子,是菱形畸变的γ-AuZn的(\sqrt{3}a×\sqrt{3}a×c)超结构。该结构主要是四面体密堆积。γ-AuZn的形成可以在休姆-罗瑟里稳定机制的框架内理解,其价电子浓度为1.68 e/a(每个原子的价电子数)。

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