A short-range ordering description of amorphous metal alloys using the central atoms model

被引:19
作者
Lass, Eric A. [1 ]
Zhu, Aiwu [1 ]
Shiflet, G. J. [1 ]
Poon, S. Joseph [1 ,2 ]
机构
[1] Univ Virginia, Dept Mat Sci & Engn, Charlottesville, VA 22903 USA
[2] Univ Virginia, Dept Phys, Charlottesville, VA 22901 USA
关键词
Metallic glasses; Short-range ordering; Thermodynamics; Modeling; Atomic structure; X-RAY-DIFFRACTION; NEUTRON-DIFFRACTION; LOCAL-STRUCTURE; CU-ZR; GLASS; ENERGY; STABILITY; EXAFS; STATE; NI;
D O I
10.1016/j.actamat.2010.06.022
中图分类号
T [工业技术];
学科分类号
08 ;
摘要
A description of the atomic structural properties of a binary metallic glass is developed by employing the central atoms model (CAM). The original CAM, derived for crystalline materials, is extended to the amorphous phase by utilizing the short-range order (SRO) inherent in the glassy structure. CAM is then validated through comparison of calculated short-range atomic structure with calculation from other models, as well as with experimental data. Predicted partial coordination numbers are in general agreement with those determined by neutron and X-ray scattering experiments. When applied to Zr- and Fe-based binary metallic glasses, chemical ordering is observed, occurring most prominently at compositions experimentally shown to possess the best glass-forming ability. The model suggests the observed differences in glass stability between Cu- and Ni-Zr binary alloys are a result of the local atomic arrangements around Cu and Ni atoms. Published by Elsevier Ltd. on behalf of Acta Materialia Inc.
引用
收藏
页码:5460 / 5470
页数:11
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