Ferroelectricity Driven by the Noncentrosymmetric Magnetic Ordering <?format ?>in Multiferroic : A First-Principles Study

C Wang, GC Guo, L He - Physical review letters, 2007 - APS
C Wang, GC Guo, L He
Physical review letters, 2007APS
The ground state structural, electronic, and magnetic properties of multiferroic TbMn 2 O 5
are investigated via first-principles calculations. We show that the ferroelectricity in TbMn 2 O
5 is driven by the noncentrosymmetric magnetic ordering, without invoking the spin-orbit
coupling and noncollinear spins. The intrinsic electric polarization in this compound is
calculated to be 1187 nC cm-2, an order of magnitude larger than previously thought.
The ground state structural, electronic, and magnetic properties of multiferroic are investigated via first-principles calculations. We show that the ferroelectricity in is driven by the noncentrosymmetric magnetic ordering, without invoking the spin-orbit coupling and noncollinear spins. The intrinsic electric polarization in this compound is calculated to be , an order of magnitude larger than previously thought.
American Physical Society
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