Molecular-dynamics simulation of lattice thermal conductivity in Pb1-xSnxTe and Pb1-xGexTe at high temperature

被引:11
作者
Chonan, T. [1 ]
Katayama, S. [1 ]
机构
[1] Japan Adv Inst Sci & Technol, Sch Mat Sci, Nomi, Ishikawa 9231292, Japan
关键词
lattice thermal conductivity; molecular-dynamics simulation; PbTe-based alloys;
D O I
10.1143/JPSJ.75.064601
中图分类号
O4 [物理学];
学科分类号
0702 ;
摘要
Molecular-dynamics studies on lattice thermal conductivity (kappa(L)) of Pb1-xSnxTe and Pb1-xGexTe are carried out by employing ion model potential for mutual ion-ion interactions at the average temperatures 300 and 500 K under non-equilibrium condition. Special emphasis of investigation is placed on the alloying effects of kappa(L) calculated by changing the alloy content x in PbTe-based alloys. It has been shown that a remarkable reduction of kappa(L) at finite x is demonstrated in Pb1-xSnxTe and Pb1-xGexTe without relying on a phonon scattering description. We have compared our results with ones evaluated by the Abeles' formula of lattice thermal conductivity due to phonon scattering from alloy fluctuations.
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页数:8
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