The electronic structure of zirconium in hydrided and oxidized states

Hamed Akhiani,A Hunt,Xiaoyu Cui,A Moewes,J A Szpunar

Journal of Alloys and Compounds（2015）

引用 13|浏览7

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摘要

•XANES and XPS of zirconium in oxidized and hydrided states were studied.•The variations in the XANES spectra are explained with density functional theory.•Hydrogen preferentially bonds to specific oxygen sites in the monoclinic ZrO2.•The monoclinic ZrO2 offers the strongest barrier against hydriding attack.

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关键词

Zirconium,Zirconium oxide,Zirconium hydride,XPS,XANES

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