ELECTRONIC-STRUCTURE AND SHORT-RANGE ORDER OF AMORPHOUS AND CRYSTALLINE ALLOYS IN THE COHERENT LOCATOR APPROXIMATION

被引:9
作者
BATIREV, IG [1 ]
LEIRO, JA [1 ]
NIKIFOROVA, LA [1 ]
KATSNELSON, AA [1 ]
机构
[1] UNIV TURKU,DEPT APPL PHYS,SF-20500 TURKU 50,FINLAND
关键词
BAND STRUCTURE; NEAREST NEIGHBOR INTERACTIONS;
D O I
10.1016/0022-3697(93)90245-M
中图分类号
O6 [化学];
学科分类号
0703 ;
摘要
Calculations of the density of valence states, the charge transfer and the free energy for amorphous alloys of transition metals were performed to determine the short range order parameter. An estimate of the influence of topological disorder on the electronic structure was also made analytically to obtain the exact solution of the coherent potential approximation (CPA) equations with a Lorenzian-like shape describing the density of states of pure metals. Ni-Zr and Fe-Zr alloys were considered as specific examples.
引用
收藏
页码:779 / 784
页数:6
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