Exploring functionalized Zr$_2$N and Sc$_2$N MXenes as superconducting candidates with $\textit{ab initio}$ calculations

We explore the possibility of obtaining new superconductor candidates from functionalized MXene compounds Zr$_2$NS$_2$, Zr$_2$NCl$_2$, and Sc$_2$NCl$_2$ based on $\textit{ab initio}$ calculations with density functional theory for superconductors (SCDFT). The predicted superconducting transition tem...

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Bibliographic Details
Main Authors: Tatan, Alpin N, Sugino, Osamu
Format: Journal Article
Language:English
Published: 18-09-2024
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