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Evolution of crystal structures in GeTe during phase transition

We investigated changes in the crystal structure of GeTe during its phase transition. Using density functional theory (DFT) calculations, four possible crystal structures were identified: R3m, P1, Cm, and Fm3m. Among these, P1 and Cm were examined here for the first time. By calculating the internal...

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Publicat a:Sci Rep
Autors principals: Jeong, Kwangsik, Park, Seungjong, Park, Dambi, Ahn, Min, Han, Jeonghwa, Yang, Wonjun, Jeong, Hong-Sik, Cho, Mann-Ho
Format: Artigo
Idioma:Inglês
Publicat: Nature Publishing Group UK 2017
Matèries:
Accés en línia:https://ncbi.nlm.nih.gov/pmc/articles/PMC5430439/
https://ncbi.nlm.nih.gov/pubmed/28424509
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1038/s41598-017-01154-z
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