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- W1665489938 abstract "Advanced first-principles calculations uncover the emergence of multiferroicity in antiferromagnetic ${text{Pr}}_{0.5}{text{Ca}}_{0.5}{text{MnO}}_{3}$ upon structural transition to a low-symmetry electrically polarized structure, found to be the ground state according to total energy. The electric polarization is not axial but lies in the basal plane. It is due to the combination of magnetic ordering with two byproducts of the oxygen-rotation-driven structural transformation: a polar ferroelectric mode in the chain-parallel direction and a change in orbital ordering orthogonally to the chains." @default.
- W1665489938 created "2016-06-24" @default.
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- W1665489938 date "2010-10-14" @default.
- W1665489938 modified "2023-09-25" @default.
- W1665489938 title "Multiferroicity and orbital ordering in<mml:math xmlns:mml=http://www.w3.org/1998/Math/MathML display=inline><mml:mrow><mml:msub><mml:mrow><mml:mtext>Pr</mml:mtext></mml:mrow><mml:mrow><mml:mn>0.5</mml:mn></mml:mrow></mml:msub><mml:msub><mml:mrow><mml:mtext>Ca</mml:mtext></mml:mrow><mml:mrow><mml:mn>0.5</mml:mn></mml:mrow></mml:msub><mml:msub><mml:mrow><mml:mtext>MnO</mml:mtext></mml:mrow><mml:mn>3</mml:mn></mml:msub></mml:mrow></mml:math>from first principles" @default.
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- W1665489938 doi "https://doi.org/10.1103/physrevb.82.140101" @default.
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