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X -Ray Absorption Near Edge Structure (XANES) Calculations for the Amorphous $Fe_{80}B_{20}$- and $Ni_{80}B_{20}$-Alloys

机译:非晶态$ Fe_ {80} B_ {20} $-和$ Ni_ {80} B_ {20} $-合金的X射线吸收近边缘结构(XANES)计算

摘要

anes spectra of the amorphous $Fe_{80}B_{20}$- and $Ni_{80}B_{20}$-alloys have been investigated using the electron multiple scattering theory of Durham et al. The calculations were based on several models for the structure of amorphous $Fe_{80}B_{20}$ and $Ni_{80}B_{20}$. Very good agreement between theoretical and experimental XANES curves was met. Opposite to former expectations for obtaining information on bond angles by XANES, this study shows that XANES points to more complex features of the structure than can be expressed in terms of bond angles.
机译:非晶态的Fe_ {80} B_ {20} $-和$ Ni_ {80} B_ {20} $-合金的Anes光谱已使用Durham等人的电子多重散射理论进行了研究。该计算基于非晶态Fe_ {80} B_ {20} $和$ Ni_ {80} B_ {20} $的结构模型。理论和实验XANES曲线之间的一致性很好。与以前通过XANES获得有关粘结角信息的期望相反,这项研究表明XANES指向的结构特征比粘结角所表示的更为复杂。

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