001     835946
005     20240625095036.0
024 7 _ |a 10.1103/PhysRevB.95.075145
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024 7 _ |a 0556-2805
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024 7 _ |a 1550-235X
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024 7 _ |a 2469-9950
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024 7 _ |a 2469-9969
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024 7 _ |a 2128/14944
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037 _ _ |a FZJ-2017-05078
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082 _ _ |a 530
100 1 _ |a Zhang, Guoren
|0 P:(DE-Juel1)144464
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245 _ _ |a Mott transition, spin-orbit effects, and magnetism in Ca$_{2}$ RuO$_{4}$
260 _ _ |a Woodbury, NY
|c 2017
|b Inst.
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520 _ _ |a In this work, we study the effects of spin-orbit and Coulomb anisotropy on the electronic and magnetic properties of the Mott insulator Ca$_{2}$ RuO$_{4}$. We use the local-density approximation + dynamical mean-field approach and spin-wave theory. We show that, contrary to a recent proposal, the Mott metal-insulator transition is not induced by the spin-orbit interaction. We confirm that, instead, it is mainly driven by the change in structure from long to short c-axis layered perovskite. We show that the magnetic ordering and the anisotropic Coulomb interactions play a small role in determining the the size of the gap. The spin-orbit interaction turns out to be essential for describing the magnetic properties. It not only results in a spin-wave gap, but it also enlarges significantly the magnon bandwidth.
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542 _ _ |i 2017-02-23
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700 1 _ |a Pavarini, Eva
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773 1 8 |a 10.1103/physrevb.95.075145
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|t Physical Review B
|v 95
|y 2017
|x 2469-9950
773 _ _ |a 10.1103/PhysRevB.95.075145
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856 4 _ |u https://juser.fz-juelich.de/record/835946/files/PhysRevB.95.075145.pdf
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