Influence of electron-phonon interaction on electronic structure and atomic ordering

被引:0
|
作者
Repets'ky, SP [1 ]
Shatnij, TD [1 ]
God-Levs'ka, OA [1 ]
机构
[1] Kiev Natl Univ, UA-03022 Kiev 22, Ukraine
来源
METALLOFIZIKA I NOVEISHIE TEKHNOLOGII | 2003年 / 25卷 / 04期
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中图分类号
T [工业技术];
学科分类号
08 ;
摘要
On the basis of both cluster expansion for Green functions and thermodynamical potential of electrons and phonons in disordered crystal, the computational method for parameters of interatomic correlations (short-range and long-range orders) in alloy is developed. Within the multiband s-p-d tight binding model, the numerical calculations of electron energy spectrum of ordered alloys are carried out with accounting an electron-phonon interaction. The applicability of the obtained results for the description of thermodynamical properties of transition-metal alloys with narrow energy bands is shown on an example of Ni-Ti and Fe-Cr alloys.
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页码:417 / 430
页数:14
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