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期刊论文

Ab initio study of electronic structure of strained Si1−x−yGexCy=Ge(001)

朱梓忠Liqing Wua Meichun Huang; Shuping Li and Zizhong Zhu

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摘要/描述

The ab initio pseudopotential method within the local density functional theory and virtualcrystal approximation is used to study the band gap of the Si1−x−yGexCy (y 0.09) alloys on a Ge (001) substrate. The heterojunction discontinuities are also investigated in the framework of the average bond energy theory in conjunction with the deformation potential method. The calculated results show that the energy gap still remains indirect and only a small amount of C could cause the energy gap to be shrunk signi cantly. The top of the valence bands of the strained Si1−x−yGexCy alloys on Ge (001) is signi cantly lifted and even could be greatly higher than that of Ge by the addition of small amounts of carbon. The trends of our results are consistent with other theoretical data.

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【免责声明】以下全部内容由[朱梓忠]上传于[2005年01月19日 18时24分02秒],版权归原创者所有。本文仅代表作者本人观点,与本网站无关。本网站对文中陈述、观点判断保持中立,不对所包含内容的准确性、可靠性或完整性提供任何明示或暗示的保证。请读者仅作参考,并请自行承担全部责任。

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