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Theoretical Investigations of the Hexagonal Germanium Carbonitride

The structural, mechanical, elastic anisotropic, and electronic properties of hexagonal germanium carbonitride (h-GeCN) are systematically investigated using the first-principle calculations method with the ultrasoft pseudopotential scheme in the frame of generalized gradient approximation in the pr...

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Detalles Bibliográficos
Autores principales: Yu, Xinhai, Ma, Zhenyang, Suriguge, Wang, Peng
Formato: Online Artículo Texto
Lenguaje:English
Publicado: MDPI 2018
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5978032/
https://www.ncbi.nlm.nih.gov/pubmed/29695091
http://dx.doi.org/10.3390/ma11050655