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...
Main Authors: | , , , , , , |
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Format: | Article |
Language: | English |
Published: |
Nature Publishing Group
2021-07-01
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Series: | npj Computational Materials |
Online Access: | https://doi.org/10.1038/s41524-021-00588-4 |