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Rational Design of Biaxial Tensile Strain for Boosting Electronic and Ionic Conductivities of Na(2)MnSiO(4) for Rechargeable Sodium‐Ion Batteries

Using first‐principles calculations, biaxial tensile (ϵ=2 and 4 %) and compressive (ϵ=−2 and −4 %) straining of Na(2)MnSiO(4) lattices resulted into radial distance cut offs of 1.65 and 2 Å, respectively, in the first and second nearest neighbors shell from the center. The Si−O and Mn−O bonds with p...

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Detalles Bibliográficos
Autores principales: Sakata Gurmesa, Gamachis, Teshome, Tamiru, Ermias Benti, Natei, Ayalneh Tiruye, Girum, Datta, Ayan, Setarge Mekonnen, Yedilfana, Amente Geffe, Chernet
Formato: Online Artículo Texto
Lenguaje:English
Publicado: John Wiley and Sons Inc. 2022
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9179011/
https://www.ncbi.nlm.nih.gov/pubmed/35678463
http://dx.doi.org/10.1002/open.202100289