XANES study of rhenium oxide compounds at the L1 and L3 absorption edges

被引:46
作者
Tougerti, Asma [1 ,2 ,3 ]
Cristol, Sylvain [3 ]
Berrier, Elise [3 ]
Briois, Valerie [4 ]
La Fontaine, Camille [4 ]
Villain, Francoise [4 ]
Joly, Yves [1 ,2 ]
机构
[1] CNRS, Inst Neel, F-38042 Grenoble 9, France
[2] Univ Grenoble 1, F-38042 Grenoble 9, France
[3] Univ Lille 1, UMR CNRS 8181, Unite Catalyse & Chim Solide, F-59650 Villeneuve Dascq, France
[4] LOrme Merisiers St Aubin, Synchrotron Soleil, F-91192 Gif Sur Yvette, France
关键词
CRYSTAL-STRUCTURE; CATALYSTS; RE2O7; REO3;
D O I
10.1103/PhysRevB.85.125136
中图分类号
T [工业技术];
学科分类号
08 ;
摘要
We report on the study of a set of rhenium oxide reference compounds (NH(4)eO(4), NaReO4, ReO3, ReO2, and Re2O7) using x-ray-absorption near-edge structure. The parallel use of Re L-1 and L-3 absorption edges permits a concomitant understanding of both the oxidation state and the local symmetry for these compounds. Experiments are compared with ab initio simulations. A good agreement is reached in most cases. The choice of the cluster size and the calculation method (full potential or not), which are mandatory ingredients allowing a satisfactory reproduction of the recorded spectra, is discussed in detail. In the meantime, these parameters give important pieces of information on the studied materials.
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页数:8
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