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• W3176712611 endingPage "29779" @default.
• W3176712611 startingPage "29770" @default.
• W3176712611 abstract "Using density functional theory calculations, we examine the effect of hole doping on the magnetic and electronic properties of CuMIIIAO2, with MIIIA = Al, Ga, and In. CuMIIIAO2 nonmagnetic semiconductors switch to ferromagnetic half-metals upon hole doping. For CuAlO2, the nonmagnetic-to-ferromagnetic transition occurs for hole densities of ∼7 × 1019/cm3. Ferromagnetism arises from an exchange splitting of the electronic states at the valence band edge, and it can be attributed to the high-lying Cu-d states. Hole doping induced by cation vacancies and substitutional divalent dopants is also investigated. Interestingly, both vacancies and nonmagnetic divalent dopants result in the emergence of ferromagnetism." @default.
• W3176712611 created "2021-07-05" @default.
• W3176712611 creator A5042669509 @default.
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• W3176712611 date "2021-06-21" @default.
• W3176712611 modified "2023-10-12" @default.
• W3176712611 title "Stoner Ferromagnetism in Hole-Doped CuM^IIIAO₂ with M^IIIA = Al, Ga, and In" @default.
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• W3176712611 doi "https://doi.org/10.1021/acsami.1c00403" @default.
• W3176712611 hasPubMedCentralId "https://www.ncbi.nlm.nih.gov/pmc/articles/8289245" @default.
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