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W2046480782 abstract "Based on density functional calculation using the local density $mathrm{approximation}+mathrm{U}$ method, we predict that osmium compounds such as ${mathrm{CaOs}}_{2}{mathrm{O}}_{4}$ and ${mathrm{SrOs}}_{2}{mathrm{O}}_{4}$ can be stabilized in the geometrically frustrated spinel crystal structure. They show ferromagnetic order in a reasonable range of the on-site Coulomb correlation U and exotic electronic properties, in particular, a large magnetoelectric coupling characteristic of axion electrodynamics. Depending on U, other electronic phases including a 3D Weyl semimetal and Mott insulator are also shown to occur." @default.
W2046480782 created "2016-06-24" @default.
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W2046480782 date "2012-04-05" @default.
W2046480782 modified "2023-10-12" @default.
W2046480782 title "Computational Design of Axion Insulators Based on<mml:math xmlns:mml=http://www.w3.org/1998/Math/MathML display=inline><mml:mn>5</mml:mn><mml:mi>d</mml:mi></mml:math>Spinel Compounds" @default.
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W2046480782 doi "https://doi.org/10.1103/physrevlett.108.146601" @default.
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