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Evolution of the Structural, Mechanical, and Phonon Properties of GeSe Polymorphs in a Pressure-Induced Second-Order Phase Transition

A pressure-induced structural transition from the layered-like phase (Pnma) to another bilayer structure (Cmcm) in GeSe was investigated with first principle calculations. The variations of the structural, electronic, elastic, and vibrational properties of GeSe with the application of pressure were...

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Bibliografiske detaljer
Udgivet i:Materials (Basel)
Main Authors: Yang, Jianhui, Fan, Qiang, Xiao, Bing, Ding, Yingchun
Format: Artigo
Sprog:Inglês
Udgivet: MDPI 2019
Fag:
Online adgang:https://ncbi.nlm.nih.gov/pmc/articles/PMC6862562/
https://ncbi.nlm.nih.gov/pubmed/31684184
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.3390/ma12213612
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