Soft-mode dynamics in the ferroelectric phase transition of GeTe

Abstract GeTe that exhibits a strong anharmonicity and a ferroelectric phase transition between the rhombohedral and cubic structures has emerged as one of the leading thermoelectric materials. Herein, combining molecular dynamics simulations and inelastic neutron scattering measurements, the lattic...

Full description

Bibliographic Details
Main Authors: Chen Wang, Jiangtao Wu, Zezhu Zeng, Jan Embs, Yanzhong Pei, Jie Ma, Yue Chen
Format: Article
Language:English
Published: Nature Publishing Group 2021-07-01
Series:npj Computational Materials
Online Access:https://doi.org/10.1038/s41524-021-00588-4