Resonant x-ray diffraction as a tool to calculate mixed valence ratios:: Application to Prussian Blue materials

被引:16
作者
Ferreira, Fabio Furlan [1 ]
Bueno, Paulo R. [2 ]
Setti, Grazielle O. [2 ]
Gimenez-Romero, David [3 ]
Garcia-Jareno, Jose Juan [3 ]
Vicente, Francisco [3 ]
机构
[1] Lab Nacl Luz Sincrotron, BR-13083970 Campinas, SP, Brazil
[2] Univ Estadual Paulista, Inst Quim, BR-14800900 Sao Paulo, Brazil
[3] Univ Valencia, Dept Quim Fis, E-46100 Valencia, Spain
基金
巴西圣保罗研究基金会;
关键词
D O I
10.1063/1.2952457
中图分类号
O59 [应用物理学];
学科分类号
摘要
An approach is proposed here to calculate mixed valence ratios in molecular compounds. Synchrotron x-ray powder diffraction experiments were conducted to determine the Fe+3/Fe+2 ratio in Prussian Blue compounds, which were elected as an example of the use of this approach. As a result, a resonant x-ray diffraction measurement provided direct evidence that the vacant [Fe(CN)(6)] group was randomly absent from similar to 31% of the structure, which was indicated by structural differences caused by variations in the anomalous dispersion term. These findings are very important for a deeper understanding of the changes occurring in properties during in situ compositional variations. (c) 2008 American Institute of Physics.
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页数:3
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