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Yukitoshi Motome

Publications and source records attributed to Yukitoshi Motome.

At least 109 records · Page 6Linked to original sources

Majorana-Magnon Crossover by a Magnetic Field in the Kitaev Model: Continuous-Time Quantum Monte Carlo Study

Kitaev quantum spin liquids host Majorana fermions via the fractionalization of spins. In a magnetic field, the Majorana fermions were predicted to comprise a topological state, which has attracted great attention by the discovery of the half-quantized thermal Hall conductivity. Nevertheless, a reliable theory remains elusive for the field effect, especially at finite temperature. Here we present unbiased large-scale numerical results for the Kitaev model in a wide range of magnetic field and temperature. We find that the unconventional paramagnetic region showing fractional spin dynamics extends at finite temperature, far beyond the field range where the topological state is expected at zero temperature. Our results show the confinement-deconfinement behavior between the fractional Majorana excitations and the conventional magnons.

cond-mat.str-el↗

Magnetic hedgehog lattices in noncentrosymmetric metals

The magnetic hedgehog lattice (HL) is a noncoplanar magnetic texture with a periodic array of magnetic monopoles and anti-monopoles. Despite phenomenological and numerical studies thus far, there remain open issues on the microscopic origin, especially with respect to the recent experimental findings of two different types of HLs even at zero magnetic field. Here, we study the stability of the HLs for an effective spin model with long-range interactions arising from itinerant nature of electrons. By variational calculations and simulated annealing, we find that the HLs are stabilized in the ground state at zero magnetic field by the synergetic effect of the anti-symmetric exchange interactions generated by the spin-orbit coupling and the multiple-spin interactions generated by the spin-charge coupling. We also clarify the phase diagram in the magnetic fields, which includes topological phase transitions with pair annihilation of the monopoles and anti-monopoles depending on the field directions.

cond-mat.str-el↗

Computational design of $f$-electron Kitaev magnets: honeycomb and hyperhoneycomb compounds $A_2$PrO$_3$ ($A=$ alkali metals)

The Kitaev spin model offers an exact quantum spin liquid in the ground state, which has stimulated exploration of its material realization over the last decade. Thus far, most of the candidates are found in $4d$- and $5d$-electron compounds, in which the low-spin $d^5$ electron configuration subject to strong spin-orbit coupling comprises a Kramers doublet with the effective angular momentum $j_{\rm eff}=1/2$ and gives rise to the bond-dependent anisotropic interactions in the Kitaev model. Here we theoretically investigate other candidates in $4f$-electron compounds with the $f^1$ electron configuration on both quasi-two-dimensional honeycomb and three-dimensional hyperhoneycomb structures, $A_2$PrO$_3$ with $A$=Li, Na, K, Rb, and Cs. Based on {\it ab initio} calculations, we show that the electronic structures of these compounds host a spin-orbital entangled Kramers doublet with $j_{\rm eff}=1/2$ in the $Γ_7$ state. By constructing the tight-binding Hamiltonian and performing a perturbation expansion, we find that the low-energy magnetic properties of $A_2$PrO$_3$ are well described by an effective spin model with the $J$-$K$-$Γ'$ model. The most remarkable feature is that the Kitaev interaction $K$ is antiferromagnetic, in contrast to the ferromagnetic one in the $d^5$ candidates at hand. The exchange interactions are systematically modulated by changing the $A$-site cations. As a consequence, the compounds with $A$=Li and Na may have a dominant antiferromagnetic $K$, but $J$ dominates $K$ and $Γ'$ in the cases with $A$=Rb and Cs. Also, by computing the ground states of the $J$-$K$-$Γ'$ model by using the exact diagonalization, we map out the systematic evolution of the model parameters in the phase diagram. Our results will stimulate material exploration of the antiferromagnetic Kitaev interaction in $f$-electron compounds.

cond-mat.str-el↗

Hunting Majorana Fermions in Kitaev Magnets

A Majorana fermion is a fermionic particle that is its own antiparticle. Since the theoretical discovery in 1937, the exotic particle has long been searched in particle physics. In the last few decades, however, it has attracted renewed interest in condensed matter physics, where it can be realized as an elementary excitation (quasiparticle) in quantum states of matter. In this review, we discuss another platform for Majorana fermions, the quantum spin liquid, in which interacting magnetic moments remain disordered down to the lowest temperature under strong quantum fluctuations. They are characterized by topological entanglement and fractional excitations, whose possible application to topological quantum computation is recently discussed intensively. As a prime candidate for such exotic states, we here focus on the Kitaev magnets, a subgroup of the spin-orbit Mott insulators. After a brief overview of the Kitaev model and the fractionalization of spins in the exact ground state, we review recent explosive development in this rapidly growing field, with a focus on numerical solutions of the Kitaev model at finite temperatures and the comparison with experiments. The key concept is thermal fractionalization --- two types of fractional excitations manifest themselves at largely different temperatures. This leads to distinct thermodynamics and spin dynamics in a variety of experimentally measurable quantities. We discuss such peculiar behaviors as the signatures of fractional quasiparticles, in careful comparison with the available experimental data for the candidate materials of the Kitaev magnets. Our review gives an overview of the current status of the identification of Majorana fermions in the Kitaev magnets, which would serve as a basis for further experimental and theoretical studies toward the manipulation of the exotic particles for topological quantum computation.

cond-mat.str-el↗

Chiral spin liquids with crystalline $\mathbb{Z}_2$ gauge order in a three-dimensional Kitaev model

Chiral spin liquids (CSLs) are time-reversal symmetry breaking ground states of frustrated quantum magnets that show no long-range magnetic ordering, but instead exhibit topological order and fractional excitations. Their realization in simple and tractable microscopic models has, however, remained an open challenge for almost two decades until it was realized that Kitaev models on lattices with odd-length loops are natural hosts for such states, even in the absence of a time-reversal symmetry breaking magnetic field. Here we report on the formation of CSLs in a three-dimensional Kitaev model, which differ from their widely studied two-dimensional counterparts, namely, they exhibit a crystalline ordering of the $\mathbb{Z}_2$ gauge fluxes and thereby break some of the underlying lattice symmetries. We study the formation of these unconventional CSLs via extensive quantum Monte Carlo simulations and demonstrate that they are separated from the featureless paramagnet at high temperatures by a single first-order transition at which both time-reversal and lattice symmetries are simultaneously broken. Using variational approaches for the ground state, we explore the effect of varying the Kitaev couplings and find at least five distinct CSL phases, all of which possess crystalline ordering of the $\mathbb{Z}_2$ gauge fluxes. For some of these phases, the complementary itinerant Majorana fermions exhibit gapless band structures with topological features such as Weyl nodes or nodal lines in the bulk and Fermi arc or drumhead surface states.

cond-mat.str-el↗

Direct Evidence for Fermi Statistics from Proximity to the Kitaev Spin Liquid in RuCl3

A key characteristic of quantum spin liquids(QSL) is the presence of fractional excitations related to their entanglement properties, yet experimental verification of their statistics is missing. For example, in the potential Kitaev spin liquid, RuCl3 experiments uncovered signs of fractional particles, though not their Fermi statistics. Here we employ Raman scattering to reveal the true nature of the magnetic excitations, using improved experimental methods and analysis to remove the influence of laser heating and thermal fluctuations. Via the energy loss and gain spectra, we extract the energy and temperature dependence of the Raman susceptibility to prove RuCl3's magnetic response is given by pair creation of fermionic excitations. Furthermore, by comparing with quantum Monte Carlo (QMC) results for the exact Kitaev limit, we are able to discern the energy and temperature range where additional interaction terms are important. Our results open new directions in QSL research by providing a new way to investigate fractional excitations and the importance of terms causing spinon confinement.

cond-mat.str-el↗

First-principles studies of spin-orbital physics in pyrochlore oxides

The pyrochlore oxides $A_2B_2$O$_7$ exhibit a complex interplay between geometrical frustration, electronic correlations, and spin-orbit coupling, due to the lattice structure and active charge, spin, and orbital degrees of freedom. Understanding the properties of these materials is a theoretical chalenge, because their intricate nature depends on material-specific details and quantum many-body effects. Here we review our recent studies based on first-principles calculations and quantum many-body theories for 4$d$ and 5$d$ pyrochlore oxides with $B$=Mo, Os, and Ir. In these studies, the spin-orbit coupling and local electron correlations are treated within the LDA+$U$ and LDA+dynamical mean-field theory formalisms. We also discuss the technical aspects of these calculations.

cond-mat.str-el↗

Antiferromagnetic Kitaev Interactions in Polar Spin-Orbit Mott Insulators

A bond-directional anisotropic exchange interaction, called the Kitaev interaction, is a promising route to realize quantum spin liquids. The Kitaev interactions were found in Mott insulators with the strong spin-orbit coupling, in the presence of quantum interference between indirect electron transfers. Here we theoretically propose a different scenario by introducing a polar structural asymmetry that unbalances the quantum interference. We show that the imbalance activates additional exchange processes and gives rise to a dominant antiferromagnetic Kitaev interaction, in stark contrast to the conventional ferromagnetic ones. We demonstrate by ab initio calculations that polar Ru trihalides with multiple anions, $α$-RuH$_{3/2}X_{3/2}$ ($X$=Cl and Br), exhibit the antiferromagnetic Kitaev interaction whose magnitude is several times larger compared to existing candidates. Our proposal opens the way for materializing the Kitaev spin liquids in unexplored parameter regions.

cond-mat.str-el↗

Nonequilibrium Majorana Dynamics by Quenching a Magnetic Field in Kitaev Spin Liquids

The honeycomb Kitaev spin model provides a quantum spin liquid in the ground state, where the spin excitations are fractionalized into itinerant and localized Majorana fermions; the former spectrum has a broad continuum ranging up to a high energy, while the latter has a sharp peak at a low energy. Despite tremendous efforts, it remains elusive to clearly identify these distinct Majorana excitations in experiments. Here we show their manifestation in the time evolution after quenching the magnetic field, by using the time-dependent Majorana mean-field theory for both the ferromagnetic and antiferromagnetic Kitaev models. We find that the transient spin dynamics from the quantum spin liquid states is qualitatively different from the conventional spin precessions by the quench from the high-field forced-ferromagnetic state. We obtain peculiar time evolutions with distinct time scales, i.e., short-time decay of high-energy components associated with the itinerant Majorana excitations, and long-lived excitations at a low energy by the localized ones. These peculiar behaviors are caused by the energy transfer between the two Majorana quasiparticles after the field quench. Moreover, we find that the Majorana semimetal with the point nodes in equilibrium turns into a Majorana metal with the transient "Fermi surfaces" by the energy transfer. In particular, for the quench from the intermediate-field quantum spin liquid in the antiferromagnetic Kitaev model, the Fermi surfaces change their topology in the time evolution, which is regarded as a dynamical version of the Majorana "Lifshitz transition". Our results unveil that the real-time dynamics provides another route to not only the identification of the fractional Majorana excitations in candidate materials of Kitaev magnets but also unprecedented quantum phases that cannot be stabilized as the equilibrium states.

cond-mat.str-el↗

Magnetic Vortex induced by Nonmagnetic Impurity in Ferromagnets: Magnetic Multipole and Toroidal around the Vacancy

We report our theoretical study on nucleation of a magnetic vortex around a nonmagnetic impurity doped into ferromagnets. The mechanism lies in the asymmetric Dzyaloshinskii-Moriya interaction arising from the breaking of spatial inversion symmetry by the impurity. By using the spin-wave analysis and Monte Carlo simulations, we show that the asymmetric interaction induces a magnetic vortex with nonzero vorticity $l=+1$. The vortex is stabilized even for less frustration in exchange interactions and in the absence of an external magnetic field. We also find that the magnetic vortex is characterized by magnetic multipoles according to its vorticity and helicity. We demonstrate a potential realization of such a magnetic vortex by considering a monolayer ferromagnet on a nonmagnetic substrate, which results in the magnetic monopole and toroidal dipole.

cond-mat.str-el↗

Spin-current diode with a monoaxial chiral magnet

Monoaxial chiral magnets exhibit a chiral conical magnetic state in a magnetic field parallel to the chiral axis. The conical spins carry the potential for nonreciprocal transport phenomena, as they break both spatial inversion and time reversal symmetries. Here we study the spin-dependent transport in the chiral conical magnetic state, using the Landauer method based on Green's functions for a one-dimensional Kondo lattice model. We show that the system exhibits nonreciprocal spin transport, which depends on the chirality, period, cone angle, and the polarization of the spin current. In particular, we find the distinct cone angle dependence between the spin textures with long and short periods. We also show that the nonreciprocity is related with the spin states of itinerant electrons near the leads. Our results indicate that the chiral cone acts as a spin-current diode, which can be flexibly controlled by a magnetic field.

cond-mat.str-el↗

Magnetoelectric effect in band insulator-ferromagnet heterostructures

We theoretically study magnetoelectric effects in a heterostructure of a generic band insulator and a ferromagnet. In contrast to the kinetic magnetoelectric effect in metals, referred to as the Edelstein effect or the inverse spin galvanic effect, our mechanism relies on virtual interband transitions between the valence and conduction bands and therefore immune to disorder or impurity scattering. By calculating electric field-induced magnetization by the linear response theory, we reveal that the magnetoelectric effect shows up without specific parameter choices. The magnetoelectric effect qualitatively varies by changing the direction of the magnetic moment in the ferromagnet: the response is diagonal for the out-of-plane moment, whereas it is off-diagonal for the inplane moment. We also find out that in optical frequencies, the magnetoelectric signal can be drastically enhanced via interband resonant excitations. Finally, we estimate the magnitude of the magnetoelectric effect for a hybrid halide perovskite semiconductor as an example of the band insulator and compare it with other magnetoelectric materials. We underscore that our mechanism is quite general and widely expectable, only requiring the Rashba spin-orbit coupling and exchange coupling. Our result could potentially offer a promising method of Joule heating-free electric manipulation of magnetic moments in spintronic devices.

cond-mat.mtrl-sci↗

Spin current generation in organic antiferromagnets

Spin current--a flow of electron spins without a charge current--is an ideal information carrier free from Joule heating for electronic devices. The celebrated spin Hall effect, which arises from the relativistic spin-orbit coupling, enables us to generate and detect spin currents in inorganic materials and semiconductors, taking advantage of their constituent heavy atoms. In contrast, organic materials consisting of molecules with light elements have been believed to be unsuited for spin current generation. Here we show that a class of organic antiferromagnets with checker-plate type molecular arrangements can serve as a spin current generator by applying a thermal gradient or an electric field, even with vanishing spin-orbit coupling. Our findings provide another route to create a spin current distinct from the conventional spin Hall effect and open a new field of spintronics based on organic magnets having advantages of small spin scattering and long lifetime.

cond-mat.str-el↗

Band crossings in honeycomb-layered transition metal compounds

Two-dimensional electron dispersions with peculiar band crossings provide a platform for realizing topological phases of matter. Here we theoretically show that the $e_g$-orbital manifold of honeycomb-layered transition metal compounds accommodates a plethora of peculiar band crossings, such as multiple Dirac point nodes, quadratic band crossings, and line nodes. From the tight-binding analysis, we find that the band topology is systematically changed by the orbital dependent transfer integrals on the honeycomb network of edge-sharing octahedra, which can be modulated by distortions of the octahedra as well as chemical substitutions. The band crossings are gapped out by the spin-orbit coupling, which brings about a variety of topological phases distinguished by the spin Chern numbers. The results provide a comprehensive understanding of the previous studies on various honeycomb compounds. We also propose another candidate materials by ab initio calculations.

cond-mat.mtrl-sci↗

Electric Toroidal Quadrupoles in Spin-Orbit Coupled Metal Cd$_2$Re$_2$O$_7$

We report our theoretical results on the order parameters for the pyrochlore metal Cd$_2$Re$_2$O$_7$, which undergoes enigmatic phase transitions with inversion symmetry breaking. By carefully examining active electronic degrees of freedom based on the lattice symmetry, we propose that two parity-breaking phases at ambient pressure are described by unconventional multipoles, electric toroidal quadrupoles (ETQs) with different components, $x^2-y^2$ and $3z^2-r^2$, in the pyrochlore tetrahedral unit. We elucidate that the ETQs are activated by bond or spin-current order on Re-Re bonds. Our ETQ scenario provides a key to reconcile the experimental contradictions, by measuring ETQ specific phenomena, such as peculiar spin splittings in the electronic band structure, magneto-current effect, and nonreciprocal transport under a magnetic field.

cond-mat.str-el↗

Effect of magnetic anisotropy on Skyrmions with a high topological number in itinerant magnets

We report our numerical results for the effect of magnetic anisotropy on a Skyrmion crystal with a high topological number of two, which was recently discovered in an itinerant electron model [R. Ozawa, S. Hayami, and Y. Motome, Phys. Rev. Lett. 118, 147205 (2017)]. By performing numerical simulations based on the kernel polynomial method and the Langevin dynamics for the Kondo lattice model on a triangular lattice, we find that the topological property remains robust against the single-ion anisotropy, while the magnetic texture is deformed continuously. The resultant spin structure is characterized by three wave numbers (triple-$Q$ state), in which the $xy$ component of spins forms a magnetic vortex crystal and the $z$ component of spins behaves a sinusoidal wave. For larger anisotropy, we show that the system exhibits a phase transition from the Skyrmion crystal to topologically trivial phases with vanishing scalar chirality: a single-$Q$ collinear and double-$Q$ noncoplanar states for the easy-axis and easy-plane anisotropy, respectively. We also examine the effect of the single-ion anisotropy in an external magnetic field, and find that the field range of the Skyrmion crystal is rather insensitive to the anisotropy, in contrast to another Skyrmion crystal with the topological number of one whose field range is considerably extended (reduced) by the easy-axis (easy-plane) anisotropy.

cond-mat.str-el↗

Magnetoelectric behavior from cluster multipoles in square cupolas: Study of Sr(TiO)Cu$_4$(PO$_4$)$_4$ in comparison with Ba and Pb isostructurals

We report our combined experimental and theoretical study of magnetoelectric properties of an antiferromagnet Sr(TiO)Cu$_4$(PO$_4$)$_4$, in comparison with the isostructurals Ba(TiO)Cu$_4$(PO$_4$)$_4$ and Pb(TiO)Cu$_4$(PO$_4$)$_4$. The family of compounds commonly possesses a low-symmetric magnetic unit called the square cupola, which is a source of magnetoelectric responses associated with the magnetic multipoles activated under simultaneous breaking of spatial inversion and time reversal symmetries. Measuring the full magnetization curves and the magnetic-field profiles of dielectric constant for Sr(TiO)Cu$_4$(PO$_4$)$_4$ and comparing them with the theoretical analyses by the cluster mean-field theory, we find that the effective $S=1/2$ spin model, which was used for the previous studies for Ba(TiO)Cu$_4$(PO$_4$)$_4$ and Pb(TiO)Cu$_4$(PO$_4$)$_4$, well explains the experimental results by tuning the model parameters. Furthermore, elaborating the phase diagram of the model, we find that the square cupolas could host a variety of magnetic multipoles, i.e., monopole, toroidal moment, and quadrupole tensor, depending on the parameters that could be modulated by deformations of the magnetic square cupolas. Our results not only provide a microscopic understanding of the series of the square cupola compounds, but also stimulate further exploration of the magnetoelectric behavior arising from cluster multipoles harboring in low-symmetric magnetic units.

cond-mat.str-el↗

Multiple-$Q$ magnetic orders in Rashba-Dresselhaus metals

We study magnetic textures realized in noncentrosymmetric Kondo lattice models, in which localized magnetic moments weakly interact with itinerant electrons subject to Rashba and Dresselhaus spin-orbit couplings. By virtue of state-of-the-art numerical simulations as well as variational calculations, we uncover versatile multiple-$Q$ orderings under zero magnetic field, which are found to originate in the instabilities of the Fermi surface whose spin degeneracy is lifted by the spin-orbit couplings. In the case with equally-strong Rashba and Dresselhaus spin-orbit couplings, which is known to realize a persistent spin helix in semiconductor quantum wells, we discover a sextuple-$Q$ magnetic ordering with a checkerboard-like spatial pattern of the spin scalar chirality. In the presence of either Rashba or Dresselhaus spin-orbit coupling, we find out another multiple-$Q$ ordering, which is distinct from Skyrmion crystals discussed under the same symmetry. Our results indicate that the cooperation of the spin-charge and spin-orbit couplings brings about richer magnetic textures than those studied within effective spin models. The situations would be experimentally realized, e.g., in noncentrosymmetric heavy-fermion compounds and heterostructures of spin-orbit coupled metals and magnetic insulators.

cond-mat.str-el↗