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Structure and bonding in YH_x as derived from elastic and inelastic light scattering

机译:弹性和非弹性光散射在YH_x中的结构和键合

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摘要

The optical properties in the visible and infrared (IR) as well as the Raman effect are reported for thin films of YH_x with 2<=x<=3. From an analysis of the IR spectra, the Szigeti effective charges have been derived. It is found that in the insulating gamma phase (x approx= 3) hydrogen is negatively charged with a transfer of about 0.5 e to every hydrogen atom. Raman scattering spectra display one line in YH_2 and up to 13 lines in YH_3. A comparison with spectra of deuterated samples allows to identify hydrogen vibrations. An analysis of the polarization dependence evidences that the structure is non-centrosymmetric. The results support models for the electronic structure which assume strong electron correlations.
机译:据报道,YH_x薄膜的2 <= x <= 3可见光和红外(IR)光学特性以及拉曼效应。通过对IR光谱的分析,得出了Szigeti有效电荷。发现在绝缘的γ相(x约= 3)中,氢带负电荷,每个氢原子的转移量约为0.5 e。拉曼散射光谱在YH_2中显示1条线,在YH_3中显示13条线。与氘代样品的光谱进行比较可以识别氢振动。对偏振依赖性的分析表明该结构是非中心对称的。结果支持了具有强电子相关性的电子结构模型。

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