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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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Bibliografiska uppgifter
I publikationen:Materials (Basel)
Huvudupphovsmän: Yang, Jianhui, Fan, Qiang, Xiao, Bing, Ding, Yingchun
Materialtyp: Artigo
Språk:Inglês
Publicerad: MDPI 2019
Ämnen:
Länkar: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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