The effect of oxygen vacancy on magnetism of geometrically frustrated triangular lattice CuFeO2: Ab initio study
Journal of Magnetism and Magnetic Materials(2019)
摘要
•The oxygen vacancy can lead to change in valence of Fe and Cu ion.•The stability of AFM structure enhance when the oxygen vacancy appears.•There exist a powerful magnetoelectric coupling effect in CFO-vO crystal.
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关键词
CuFeO2,Oxygen vacancy,Magnetism,Ab initio
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