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功能性单硫属化物:拉曼光谱证据揭示性质、结构与变价键合之间的联系

Functional Monochalcogenides: Raman Evidence Linking Properties, Structure, and Metavalent Bonding.

作者信息

Bellin Christophe, Pawbake Amit, Paulatto Lorenzo, Béneut Keevin, Biscaras Johan, Narayana Chandrabhas, Polian Alain, Late Dattatray J, Shukla Abhay

机构信息

Institut de Minéralogie, de Physique des Matériaux et de Cosmochimie, Sorbonne Université, UMR CNRS 7590, MNHN, 4 Place Jussieu, F-75005 Paris, France.

Institut Neel CNRS/UGA UPR2940, MCBT, 25 rue des Martyrs BP 166, 38042 Grenoble cedex 9, France.

出版信息

Phys Rev Lett. 2020 Oct 2;125(14):145301. doi: 10.1103/PhysRevLett.125.145301.

Abstract

Pressure- and temperature-dependent Raman scattering in GeSe, SnSe, and GeTe for pressures beyond 50 GPa and for temperatures ranging from 78 to 800 K allow us to identify structural and electronic phase transitions, similarities between GeSe and SnSe, and differences with GeTe. Calculations help to deduce the propensity of GeTe for defect formation and the doping that results from it, which gives rise to strong Raman damping beyond anomalous anharmonicity. These properties are related to the underlying chemical bonding and consistent with a recent classification of bonding in several chalcogenide materials that puts GeTe in a separate class of "incipient" metals.

摘要

在50 GPa以上的压力以及78至800 K的温度范围内,对GeSe、SnSe和GeTe进行的压力和温度依赖拉曼散射研究,使我们能够识别结构和电子相变、GeSe和SnSe之间的相似性以及与GeTe的差异。计算有助于推断GeTe形成缺陷的倾向以及由此产生的掺杂,这导致了除异常非谐性之外的强烈拉曼阻尼。这些性质与潜在的化学键合有关,并且与最近对几种硫族化物材料键合的分类一致,该分类将GeTe归为一类单独的“初始”金属。

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