Site preference of Re in NiAl and valence band structure of NiAl containing Re: First-principles study and photoelectron spectrum

doi:10.1063/1.3152267

IMR OpenIR

	Site preference of Re in NiAl and valence band structure of NiAl containing Re: First-principles study and photoelectron spectrum
	Wei, H.1,2; Liang, J. J.1; Sun, B. Z.3; Zheng, Q.1; Sun, X. F.1; Peng, P.4; Yao, X.; Dargusch, M. S.2
通讯作者	Wei, H.(hwei@imr.ac.cn)
	2009-06-08
发表期刊	APPLIED PHYSICS LETTERS
ISSN	0003-6951
卷号	94 期号:23 页码:3
摘要	The site preference of Re in NiAl was studied using first-principles calculations. The calculation of formation energies of the NiAl alloys indicated the site preference of Re on the Ni sites. The valence band structures of the NiAl alloys were investigated by photoelectron spectroscopy. The valence band spectra of the NiAl with Re shifted away from the Fermi energy level so that the Ni d-band centroid moved to a higher energy by 0.25 eV as Re was added. Such a shift could be attributed to the Ni-Re interaction, which was supported by the photoelectron spectroscopy measurement.
关键词	ab initio calculations aluminium alloys Fermi level nickel alloys photoelectron spectra rhenium alloys valence bands
资助者	National Natural Sciences Foundation of China
DOI	10.1063/1.3152267
收录类别	SCI
语种	英语
资助项目	National Natural Sciences Foundation of China[50501024] ; National Natural Sciences Foundation of China[0671102]
WOS研究方向	Physics
WOS类目	Physics, Applied
WOS记录号	WOS:000266977100065
出版者	AMER INST PHYSICS
引用统计	被引频次：6[WOS] [WOS记录] [WOS相关记录]
文献类型	期刊论文
条目标识符	http://ir.imr.ac.cn/handle/321006/98385
专题	中国科学院金属研究所
通讯作者	Wei, H.
作者单位	1.CAS, Met Res Inst, Superalloys Div, Shenyang 110016, Peoples R China 2.Univ Queensland, Sch Engn, CRC, CAST, Brisbane, Qld 4072, Australia 3.Northeastern Univ, Sch Sci, Shenyang 110004, Peoples R China 4.Hunan Univ, Coll Mat Sci & Engn, Changsha 410082, Hunan, Peoples R China
推荐引用方式 GB/T 7714	Wei, H.,Liang, J. J.,Sun, B. Z.,et al. Site preference of Re in NiAl and valence band structure of NiAl containing Re: First-principles study and photoelectron spectrum[J]. APPLIED PHYSICS LETTERS,2009,94(23):3.
APA	Wei, H..,Liang, J. J..,Sun, B. Z..,Zheng, Q..,Sun, X. F..,...&Dargusch, M. S..(2009).Site preference of Re in NiAl and valence band structure of NiAl containing Re: First-principles study and photoelectron spectrum.APPLIED PHYSICS LETTERS,94(23),3.
MLA	Wei, H.,et al."Site preference of Re in NiAl and valence band structure of NiAl containing Re: First-principles study and photoelectron spectrum".APPLIED PHYSICS LETTERS 94.23(2009):3.