Structural, thermodynamic, magnetic, electronic, and mechanical properties of the hexagonal Mn3Ir: An ab initio study

The current study has employed ab initio density functional theory (DFT) simulations to investigate the thermodynamic, magnetic, electronic, and mechanical behaviour of the hexagonal ordered P63/mmc- Mn3Ir alloy at 0 K. This material is highly desirable for application in spintronic devices due to t...

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Bibliographic Details
Main Authors: Maxhayi Sikho, Lethole Ndanduleni, Diale Ramogohlo, Phasha Maje
Format: Article
Language:English
Published: EDP Sciences 2024-01-01
Series:MATEC Web of Conferences
Online Access:https://www.matec-conferences.org/articles/matecconf/pdf/2024/18/matecconf_rapdasa2024_02003.pdf
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