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Natalia B. Perkins

Publications and source records attributed to Natalia B. Perkins.

65 records · Page 4Linked to original sources

Theory of Raman response in three-dimensional Kitaev spin liquids: application to $β-$ and $γ-$Li$_2$IrO$_3$ compounds

We calculate the Raman response for the Kitaev spin model on the $\mathcal{H}$-$0$, $\mathcal{H}$-$1$, and $\mathcal{H}$-$\infty$ harmonic honeycomb lattices. We identify several quantitative features in the Raman spectrum that are characteristic of the spin liquid phase. Unlike the dynamical structure factor, which probes both the Majorana spinons and flux excitations that emerge from spin fractionalization, the Raman spectrum in the Kitaev models directly probes a density of states of pairs of fractional, dispersing Majorana spinons. As a consequence, the Raman spectrum in all these models is gapless for sufficiently isotropic couplings, with a low-energy power law that results from the Fermi lines (or points) of the dispersing Majorana spinons. We show that the polarization dependence of the Raman spectrum contains crucial information about the symmetry of the ground state. We also discuss to what extent the features of the Raman response that we find reflect generic properties of the spin liquid phase, and comment on their possible relevance to $α-$, $β-$ and $γ-$Li$_2$IrO$_3$ compounds.

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Theory of the evolution of magnetic order in Fe$_{1+y}$Te compounds with increasing interstitial iron

We examine the influence of the excess of interstitial Fe on the magnetic properties of Fe$_{1+y}$Te compounds. Because in iron chalcogenides the correlations are stronger than in the iron arsenides, we assume in our model that some of the Fe orbitals give rise to localized magnetic moments. These moments interact with each other via exchange interactions as well as phonon-mediated biquadratic interactions that favor a collinear double-stripe state, corresponding to the ordering vectors $\left(\pmπ/2,\pmπ/2\right)$. The remaining Fe orbitals are assumed to be itinerant, giving rise to the first-principle derived Fermi surface displaying nesting features at momenta $\left(π,0\right)/\left(0,π\right)$. Increasing the amount of itinerant electrons due to excess Fe, $y$, leads to changes in the Fermi surface and to the suppression of its nesting properties. As a result, due to the Hund's coupling between the itinerant and localized moments, increasing $y$ leads to modifications in the local moments' exchange interactions via the multi-orbital generalization of the long-range Ruderman-Kittel-Kasuya-Yosida (RKKY) interaction. By numerically computing the RKKY corrections and minimizing the resulting effective exchange Hamiltonian, we find, in general, that the excess electrons introduced in the system change the classical magnetic ground state from a double-stripe state to an incommensurate spiral, consistent with the experimental observations. We show that these results can be understood as a result of the suppression of magnetic spectral weight of the itinerant electrons at momenta $\left(π,0\right)/\left(0,π\right)$, combined with the transfer of broad magnetic spectral weight from large to small momenta, promoted by the introduction of excess Fe.

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Importance of anisotropic exchange interactions in honeycomb iridates. Minimal model for zigzag antiferromagnetic order in Na$_2$IrO$_3$

In this work, we investigate the microscopic nature of the magnetism in honeycomb iridium-based systems by performing a systematic study of how the effective magnetic interactions in these compounds depend on various electronic microscopic parameters. We show that the minimal model describing the magnetism in A$_2$IrO$_3$ includes both isotropic and anisotropic Kitaev-type spin-exchange interactions between nearest and next-nearest neighbor Ir ions, and that the magnitude of the Kitaev interaction between next-nearest neighbor Ir magnetic moments is comparable with nearest neighbor interactions. We also find that, while the Heisenberg and the Kitaev interactions between nearest neighbors are correspondingly antiferro- and ferromagnetic, they both change sign for the next-nearest neighbors. Using classical Monte Carlo simulations we examine the magnetic phase diagram of the derived super-exchange model. Zigzag-type antiferromagnetic order is found to occupy a large part of the phase diagram of the model and, for ferromagnetic next-nearest neighbor Heisenberg interaction relevant for Na$_2$IrO$_3$, it can be stabilized even in the absence of third nearest neighbor coupling. Our results suggest that a natural physical origin of the zigzag phase experimentally observed in Na$_2$IrO$_3$ is due to the interplay of the Kitaev anisotropic interactions between nearest and next-nearest neighbors.

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Interplay of many-body and single-particle interactions in iridates and rhodates

Motivated by recent experiments exploring the spin-orbit-coupled magnetism in $4d$- and $5d$-band transition metal oxides, we study magnetic interactions in Ir- and Rh-based compounds. In these systems, the comparable strength of spin-orbit coupling (SOC), crystal field splitting (CF) and Coulomb and Hund's coupling leads to a rich variety of magnetic exchange interactions, leading to new types of ground states. Using a strong coupling approach, we derive effective low-energy super-exchange Hamiltonians from the multi-orbital Hubbard model by taking full account of the Coulomb and Hund's interactions in the intermediate states. We find that in the presence of strong SOC and lattice distortions the super-exchange Hamiltonian contains various kinds of magnetic anisotropies. Here we are primarily interested in the magnetic properties of Sr$_2$IrO$_4$ and Sr$_2$Ir$_{1-x}$Rh$_x$O$_4$ compounds. We perform a systematic study of how magnetic interactions in these systems depend on the microscopic parameters and provide a thorough analysis of the resulting magnetic phase diagram. Comparison of our results with experimental data shows good agreement. Finally, we discuss the parameter space in which the spin-flop transition in Sr$_2$IrO$_4$, experimentally observed under pressure, can be realized.

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Finite temperature phase diagram of the classical Kitaev-Heisenberg model

We investigate the finite-temperature phase diagram of the classical Kitaev-Heisenberg model on the hexagonal lattice. Due to the anisotropy introduced by the Kitaev interaction, the model is magnetically ordered at low temperatures for all values of parameters at which the model has a discrete symmetry. The ordered phase is stabilized entropically by an order by disorder mechanism where thermal fluctuations of classical spins select collinear magnetic orders in which magnetic moments point along one of the cubic directions. We find that there is an intermediate phase between the low-temperature ordered phase and the high-temperature disordered phase. We show that the intermediate phase is a critical Kosterlitz-Thouless phase exhibiting correlations of the order parameter that decay algebraically in space. Using finite size scaling analysis, we determine the boundaries of the critical phase with reasonable accuracy. We show that the Kitaev interaction plays a crucial role in understanding the finite temperature properties of A$_2$IrO$_3$ systems.

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Raman scattering in a Heisenberg S=1/2 antiferromagnet on the anisotropic triangular lattice

We investigate the two-magnon Raman scattering from an anisotropic S=1/2 triangular Heisenberg antiferromagnet Cs2CuCl4. We find that the Raman response is very sensitive to magnon-magnon interactions and to scattering geometries, a feature that is in remarkable contrast with the polarization-independent Raman signal from the isotropic triangular Heisenberg antiferromagnet. Since a spin-liquid ground state gives rise to a similar rotationally invariant Raman response, our results on the polarization dependence of the scattering spectrum suggest that Raman spectroscopy provides a useful probe, complementary to neutron scattering, of the ground-state properties of Cs2CuCl4, particularly whether the time-reversal symmetry is broken in the ground state.

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Helimagnons in a chiral ground state of the pyrochlore antiferromagnets

The Goldstone mode in a helical magnetic phase, also known as the helimagnon, is a propagating mode with a highly anisotropic dispersion relation. Here we study theoretically the helimagnon excitations in a complex chiral ground state of pyrochlore antiferromagnets such as spinel CdCr2O4 and itinerant magnet YMn2. We show that the effective theory of the soft modes in the helical state possesses a symmetry similar to that of smectic liquid crystals. We compute the low-energy spin-wave spectrum based on a microscopic spin Hamiltonian and find a dispersion relation characteristic of the helimagnons. By performing dynamics simulations with realistic model parameters, we also obtain an overall agreement between experiment and the numerical spin-wave spectrum. Our work thus also clarifies the mechanisms that relive the magnetic frustration in these compounds.

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Critical properties of the Kitaev-Heisenberg model

We study critical properties of the Kitaev-Heisenberg model on the honeycomb lattice at finite temperatures which might describe the physics of the quasi two-dimensional compounds, Na$_2$IrO$_3$ and Li$_2$IrO$_3$. The model undergoes two phase transitions as a function of temperature. At low temperature, thermal fluctuations induce magnetic long-range order by order-by-disorder mechanism. Magnetically ordered state with the spontaneously broken $Z_6$ symmetry persists up to a certain critical temperature. We find that there is an intermediate phase between the low-temperature ordered phase and the high-temperature disordered phase. The finite-sized scaling analysis suggests that the intermediate phase is a critical Kosterlitz-Thouless phase with continuously variable exponents. We argue that the intermediate phase has been actually observed above the low-temperature magnetically ordered phase in Na$_2$IrO$_3$, and likely in Li$_2$IrO$_3$.

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Magnetism in parent Fe-chalcogenides: quantum fluctuations select a plaquette order

We analyze magnetic order in iron-chalcogenide Fe$_{1+y}$Te -- the parent compound of high-temperature superconductor Fe$_{1+y}$Te$_{1-x}$Se$_x$. Neutron scattering experiments show that magnetic order in this material contains components with momentum $Q_1=(π/2, π/2)$ and $Q_2 =(π/2, -π/2)$ in Fe-only Brillouin zone. The actual spin order depends on the interplay between these two components. Previous works argued that spin order is a single-$Q$ state (either $Q_1$ or $Q_2$). Such an order breaks rotational $C_4$ symmetry and order spins into a double diagonal stripe. We show that quantum fluctuations actually select another order -- a double $Q$ plaquette state with equal weight of $Q_1$ and $Q_2$ components, which preserves $C_4$ symmetry but breaks $Z_4$ translational symmetry. We argue that the plaquette state is consistent with recent neutron scattering experiments on Fe$_{1+y}$Te.

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Orbital disorder induced by charge fluctuations in vanadium spinels

Motivated by recent experiments on vanadium spinels, $A$V$_2$O$_4$, that show an increasing degree of electronic delocalization for smaller cation sizes, we study the evolution of orbital ordering (OO) between the strong and intermediate-coupling regimes of a multi-orbital Hubbard Hamiltonian. The underlying magnetic ordering of the Mott insulating state leads to a rapid suppression of OO due to enhanced charge fluctuations along ferromagnetic bonds. Orbital double-occupancy is rather low at the transition point indicating that the system is in the crossover region between strong and intermediate-coupling regimes when the orbital degrees of freedom become disordered.

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Quantum phase transitions in a strongly entangled spin-orbital chain: A field-theoretical approach

Motivated by recent experiments on quasi-1D vanadium oxides, we study quantum phase transitions in a one-dimensional spin-orbital model describing a Haldane chain and a classical Ising chain locally coupled by the relativistic spin-orbit interaction. By employing a field-theoretical approach, we analyze the topology of the ground-state phase diagram and identify the nature of the phase transitions. In the strong coupling limit, a long-range Néel order of entangled spin and orbital angular momentum appears in the ground state. We find that, depending on the relative scales of the spin and orbital gaps, the linear chain follows two distinct routes to reach the Néel state. First, when the orbital exchange is the dominating energy scale, a two-stage ordering takes place in which the magnetic transition is followed by melting of the orbital Ising order; both transitions belong to the two-dimensional Ising universality class. In the opposite limit, the low-energy orbital modes undergo a continuous reordering transition which represents a line of Gaussian critical points. On this line the orbital degrees of freedom form a Tomonaga-Luttinger liquid. We argue that the emergence of the Gaussian criticality results from merging of the two Ising transitions in the strong hybridization region where the characteristic spin and orbital energy scales become comparable. Finally, we show that, due to the spin-orbit coupling, an external magnetic field acting on the spins can induce an orbital Ising transition.

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