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arXiv 1003.1186cond-mat.supr-concond-mat.mtrl-sci
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对“Fe $_{1+x}$ Te超导体的掺杂驱动($π,0$)嵌套和磁性”的评论[物理评论快报]。103,067001(2009)]

Comment on "Doping Driven ($π,0$) Nesting and Magnetic Properties of Fe$_{1+x}$Te Superconductors" [Phys. Rev. Lett. 103, 067001 (2009)]

Prabhakar P. Singh

摘要:

本文将Korringa-Kohn-Rostoker相干势近似方法应用于原子球近似中,(KKR-ASA CPA)描述FeTe合金中过量Fe引起的无序效应,我们证明了(i)刚性带近似不足以描述无序效应,其应用导致对基础物理的不正确描述,(ii)从FeTe到Fe_{1.068} Te(或Fe_{1.063} Te)的~0.76 eV的刚性能带能移,如Han和Savrasov(Phys.Rev.Lett. 103,067001(2009))与我们的FP-LMTO以及KKR-ASA结果不一致,因此他们论文的图3(b)中所示的Fe_{1.063} Te的FS是不正确的。

英文摘要:

In this Comment, using Korringa-Kohn-Rostoker coherent-potential approximation method in the atomic-sphere approximation (KKR-ASA CPA) to describe the effects of disorder due to excess Fe in FeTe alloys, we show that (i) the rigid-band approximation is inadequate to describe the effects of disorder and its application leads to an incorrect description of the underlying physics, (ii) the rigid-band energy shift of ~0.76 eV for going from FeTe to Fe_{1.068}Te (or Fe_{1.063}Te), as obtained by Han and Savrasov (Phys. Rev. Lett. 103, 067001(2009)), is inconsistent with our FP-LMTO as well as the KKR-ASA results, and thus the FS of Fe_{1.063}Te shown in Fig. 3(b) of their paper is not correct.

机构、总结、中文摘要均由AI分析而来,可能存在错误,请以论文正文为准。

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