拉曼光谱
声子
异常(物理)
各向异性
中心(范畴论)
材料科学
凝聚态物理
环境压力
从头算量子化学方法
各向同性
物理
光学
化学
量子力学
结晶学
热力学
分子
作者
H. Olijnyk,A. P. Jephcoat,D. L. Novikov,N. E. Christensen
出处
期刊:Physical review
日期:2000-09-01
卷期号:62 (9): 5508-5512
被引量:47
标识
DOI:10.1103/physrevb.62.5508
摘要
The pressure dependence of the transverse-optical zone-center phonon mode of Zn was measured by means of Raman spectroscopy up to 58 GPa at room temperature. The frequency increases under pressure and no anomaly is observed in the pressure range around 10 GPa where electronic topological transitions are expected to occur, and where also ab initio ``frozen phonon'' calculations predict a weak anomaly in the $c/a$ ratio. The relatively large value of the mode Gr\"uneisen parameter ${\ensuremath{\gamma}}_{i}=\ensuremath{-}d\mathrm{ln}{\ensuremath{\nu}}_{i}/d\mathrm{ln}V$ and its strong decrease under pressure are related to the high compressional anisotropy at ambient pressure and the gradual anisotropic $\ensuremath{\rightarrow}$ isotropic transition occurring with increasing pressure in Zn, respectively. An irregularity is observed in the pressure dependence of the line width around 10 GPa which may be related to changes in the phonon-phonon and electron-phonon interactions that could be a consequence of the electronic topological transitions.
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