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High-<mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML" display="inline"><mml:msub><mml:mi>T</mml:mi><mml:mi>c</mml:mi></mml:msub></mml:math>Ferroelectricity Emerging from Magnetic Degeneracy in Cupric Oxide
Cupric oxide is multiferroic at unusual high temperatures. From density functional calculations we find that the low-T magnetic phase is paraelectric and the higher-T one ferroelectric, with a size and direction of polarization in good agreement with experiment. By mapping of the ab initio results on an effective spin model …