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Optical Constants of an Apatite Single Crystal in the IR Range of 6-28 mu m

机译:IR范围为6-28 mu m的磷灰石单晶的光学常数

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On the basis of polarized IR-reflection spectra in the range of 5000-350 cm(-1) measured from the natural face of an optically transparent fluorapatite single crystal, components of a complex refractive index (optical constants) for radiation-vector orientations E aEuro- c and E aS c have been calculated by the Kramers-Kronig method. The fluorapatite single crystal has been chosen from several samples: it contains a minimum amount of impurities and has a high degree of crystallinity in accordance with the criteria of IR spectroscopy and Raman spectroscopy. Tabular data on optical constants for ordinary and extraordinary rays are given for the IR range of 6-28 mu m. The obtained absorption spectra are compared with the results of quantum-chemical ab initio calculations within the B3LYP simulation.
机译:基于从5000-350cm(-1)范围内的偏振IR反射光谱从光学透明荧光石单晶的自然面测量,用于辐射 - 载体取向的复合折射率(光学常数)的组分 ASURO-C和E AS C已通过Kramers-Kronig方法计算。 从几个样品中选择了氟磷酸盐单晶:它含有最小量的杂质,并且根据IR光谱和拉曼光谱的标准具有高度的结晶度。 对普通和非凡光线的光学常数的表格数据用于6-28μm的IR范围。 将所得吸收光谱与B3LYP模拟中量子化学AB初始计算的结果进行比较。

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