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024 7 _ |a 10.1103/PhysRevB.99.125102
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037 _ _ |a FZJ-2020-03817
082 _ _ |a 530
100 1 _ |a Zhang, Guoren
|0 P:(DE-Juel1)144464
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245 _ _ |a Optical conductivity, Fermi surface, and spin-orbit coupling effects in Sr 2 RhO 4
260 _ _ |a Woodbury, NY
|c 2019
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520 _ _ |a By using the local-density approximation + dynamical mean-field theory approach, we study the low-energy electronic properties of $Sr_2RhO_4$ in a realistic setting, and compare to $Sr_2RuO_4$. We investigate the interplay of spin-orbit coupling, crystal field, and Coulomb interaction, including the tetragonal terms of the Coulomb tensor. We find that (i) differently than in $Sr_2RuO_4$, the zero-frequency effective crystal-field “enhancement” due to Coulomb repulsion, ΔɛCF(ω=0), is small and, depending on the parameters, even negative. (ii) In addition, the effects of (realistic) anisotropic Coulomb terms are weak. (iii) Instead, the effective zero-frequency enhancement of the spin-orbit interaction doubles the value of the corresponding local-density approximation couplings. This explains the experimental Fermi surface and supports a previous proposal based on static mean-field calculations. We find that the sign of the Coulomb-induced spin-orbit anisotropy is influenced by the octahedral rotation. Based on these conclusions, we examine recent optical conductivity experiments. (iv) We show that the spin-orbit interaction is key for understanding them; differently than in $Sr_2RuO_4$, the $t_{2g}$ intraorbital contributions are small; thus, the single-band picture does not apply.
536 _ _ |a Multiplet effects in strongly correlated materials (jiff41_20091101)
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|f Multiplet effects in strongly correlated materials
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536 _ _ |a Spin-orbital order-disorder transitions in strongly correlated systems (jiff46_20161101)
|0 G:(DE-Juel1)jiff46_20161101
|c jiff46_20161101
|f Spin-orbital order-disorder transitions in strongly correlated systems
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542 _ _ |i 2019-03-04
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700 1 _ |a Pavarini, Eva
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773 1 8 |a 10.1103/physrevb.99.125102
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|t Physical Review B
|v 99
|y 2019
|x 2469-9950
773 _ _ |a 10.1103/PhysRevB.99.125102
|g Vol. 99, no. 12, p. 125102
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|n 12
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|t Physical review / B
|v 99
|y 2019
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