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Toshihiro Sato

Publications and source records attributed to Toshihiro Sato.

At least 19 recordsLinked to original sources

Dynamical magnetotropic susceptibility as a new probe of Kitaev materials and beyond

The magnetotropic susceptibility, $k(ω)$, probes ultra-low-frequency uniform ($\boldsymbol{q}=0$) spin and charge fluctuations in a crystal mounted on an oscillating cantilever: its real part shifts the oscillation frequency, while its imaginary part characterises the induced damping. We derive $k(ω)$ within linear response theory for a generic correlated-electron Hamiltonian, showing that its real part is sensitive to magnetic anisotropy and its imaginary part encodes the uniform dynamical spin susceptibility, even for spin-symmetric insulators, while in metals it reveals eddy-current damping conditions. Using auxiliary-field quantum Monte Carlo, we compute $k(ω)$ for microscopic models of $α$-RuCl$_3$, finding that the low-temperature $k(ω=0)/T$ scaling with $B/T$ is a signature of dominant Kitaev coupling, robust to optical phonons, while the dynamical response shows local-moment-like features. We highlight applications to Kondo destruction quantum criticality, relevant to strange metallicity and unconventional superconductivity.

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Scale-invariant magnetic anisotropy in $α$-RuCl$_3$: A quantum Monte Carlo study

We compute the rotational anisotropy of the free energy of $α$-RuCl$_3$ in an external magnetic field. This quantity, known as the magnetotropic susceptibility, $k$, relates to the second derivative of the free energy with respect to the angle of rotation. We have used approximation-free, auxiliary-field quantum Monte Carlo simulations for a realistic model of $α$-RuCl$_3$ and optimized the path integral to alleviate the negative sign problem. This allows us to reach temperatures down to $30~\mathrm{K}$, an energy scale below the dominant Kitaev coupling. We demonstrate that the magnetotropic spin susceptibility in this model of $α$-RuCl$_3$ displays scaling behavior $k = T f(B/T)$ at high temperatures. Once the uniform susceptibility departs from the Curie law (i.e., at the energy scale of the exchange interactions), it appears to transition to an emergent scalinglike behavior, characterized by a different function $f$ at lower temperatures, stemming from the locality of torque fluctuations. We observe a remarkable numerical match between experiment and simulations and we also find qualitative agreement with the pure Kitaev model. In comparison, for the XXZ Heisenberg Hamiltonian, the scaling $k = T f(B/T)$ breaks down at a temperature scale where the uniform spin susceptibility deviates from the Curie law and never reemerges at low temperatures.

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Generating ferro-spinetic polarizations in altermagnetic insulators

Altermagnets are a novel class of fully spin-compensated magnetic materials that nevertheless have spin-split electronic bands, offering novel perspectives for spintronics applications. Based on a rigorous analysis of altermagnetic many-body models and their symmetry we establish the important role of two fundamental types of polarizations in altermagnetic insulators: the charge and the spinetic one, where the latter corresponds to a macroscopic spin-displacement field. First principles calculations confirm and quantify their presence in real materials. The two polarizations are directly coupled and emerge in orthogonal directions when inversion symmetry is broken, either by the system developing a spontaneously ferroelectric polarization (in ferroelectric altermagnets), or by a charge displacement induced by an external electric field (for inversion invariant altermagnetic insulators). This presence of large and switchable spin accumulations constitute an attractive fundamental feature of altermagnetic insulators.

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Revealing altermagnetic Fermi surfaces with two Kondo impurities

Motivated by recent advances in the study of altermagnetism, or unconventional magnetism, and in the realization and manipulation of two-impurity Kondo physics in real materials, we propose a phase-sensitive method to explore unconventional magnetic symmetries. Our method can be implemented with spin-resolved scanning tunneling microscopy to study two-impurity Kondo phenomena on altermagnetic metals by varying the distance and orientation between magnetic impurities. Using quantum Monte Carlo simulations, we analyze the spin splitting of the Kondo resonance, whose spatial distribution sensitively captures the symmetry of the underlying altermagnetic order. Furthermore, the impurity spin correlations reflects the anisotropy of the RKKY interaction due to the altermagnetic Fermi surface splitting. This work provides a framework for studying the competition between the Kondo effect, the RKKY interaction and altermagnetism, in the simplest possible system.

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Edge modes of topological Mott insulators and deconfined quantum critical points

Topology and anomalies lead to edge modes that can interact with critical bulk fluctuations. To study this setup, pertaining to boundary criticality, we consider a model exhibiting a deconfined quantum critical point (DQCP) between a dynamically generated quantum spin Hall state (i.e.a topological Mott insulator) and an s-wave superconductor. For the topological Mott insulator, the bulk Goldstone modes are shown to be irrelevant at the helical Luttinger liquid fixed points. The deconfined quantum critical point is an instance of an emergent anomaly, and we observe a sharp localized edge state at this point. The sharpness of the edge mode is consistent with an ordinary phase in which electronic edge modes decouple from critical edge bosonic fluctuations. At the DQCP, the scaling dimension of the edge electron shows a jump, a feature argued to be a signature of the emergent anomaly. Our results are based on large-scale auxiliary-field quantum Monte Carlo simulations.We also carry out calculations for the Kane-Mele-Hubbard model to confirm spectral features of the ordinary and extraordinary-log phases in the vicinity of the bulk critical point.

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Alteration of Topology in Quantum Phase Transitions via Symmetry Enrichment

Topology plays a cardinal role in explaining phases and quantum phase transitions beyond the Landau-Ginzburg-Wilson paradigm. In this study, we formulate a set of models of Dirac fermions in 2+1 dimensions with SU($N$)$\times$SU(2)$\times$U(1) symmetry that have the potential to host critical points described by field theories with topological terms. For $N=2$ it shows a rich phase diagram containing semimetallic, quantum spin Hall insulating, Kekulé valence bond solid and s-wave superconducting phases and features multiple Landau-Ginzburg-Wilson phase transitions driven by interaction strength. At $N=1$ a deconfined quantum critical point is observed. At $N=2$ one expects the critical theory to correspond to a level 2 Wess-Zumino-Witten theory in 2+1 dimensions. Here the numerical results however show a strong first order transition. Another transition can be governed by a topological $θ$-term which is rendered irrelevant for even values of $N$ thus leading to Landau-Ginzburg-Wilson behaviour.

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Finite temperature fermion Monte Carlo simulations of frustrated spin-Peierls systems

The Abrikosov fermion representation of the spin-1/2 degree of freedom allows for auxiliary-field quantum Monte Carlo simulations of frustrated spin systems. This approach provides a manifold of equivalent actions over which the negative sign problem can be optimised. As a result, we can reach temperature scales well below the magnetic scale. Here, we show how to generalise this algorithm to spin-Peierls systems. In contrast to exact diagonalisation approaches, Monte Carlo methods are not Hilbert space bound such that the computational effort per sweep remains invariant when adding phonons. However, the computational effort required to generate independent configurations increases in the presence of phonons. We also show that, for the specific case of the Kitaev-Heisenberg model, the inclusion of phonons does not render the negative sign problem more severe. This new algorithm hence allows us to investigate the interplay between phonon degrees of freedom and magnetic frustration. We present results for frustrated and non-frustrated spin systems.

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Altermagnetic anomalous Hall effect emerging from electronic correlations

While altermagnetic materials are characterized by a vanishing net magnetic moment, their symmetry in principle allows for the existence of an anomalous Hall effect (AHE). Here we introduce a model with altermagnetism in which the emergence of an AHE is driven by interactions. This model is grounded in a modified Kane-Mele framework with antiferromagnetic (AFM) spin-spin correlations. Quantum Monte Carlo simulations show that the system undergoes a finite temperature phase transition governed by a primary AFM order parameter accompanied by a secondary one of Haldane type. The emergence of both orders turns the metallic state of the system, away from half-filling, to an altermagnet with a finite anomalous Hall conductivity. A mean field ansatz corroborates these results, which pave the way into the study of correlation induced altermagnets with finite Berry curvature.

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Effective model for superconductivity in magic-angle graphene

We carry out large-scale quantum Monte Carlo simulations of a candidate field theory for the onset of superconductivity in magic-angle twisted bilayer graphene. The correlated insulating state at charge neutrality spontaneously breaks U(1) Moiré valley symmetry. Owing to the topological nature of the bands, skyrmion defects of the order parameter carry charge $2e$ and condense upon doping. In our calculations we encode the U(1) symmetry by an internal degree of freedom such that it is not broken upon lattice regularization. Furthermore, the skyrmion carries the same charge. The nature of the doping-induced phase transitions depends on the strength of the easy-plane anisotropy that reduces the SU(2) valley symmetry to U(1) $\times \mathbb{Z}_2 $. For large anisotropy, we observe two distinct transitions separated by phase coexistence. While the insulator to superconducting transition is of mean-field character, the U(1) transition is consistent with three-dimensional XY criticality. Hence, the coupling between the gapless charge excitations of the superconducting phase and the XY order parameter is irrelevant. At small anisotropy, we observe a first-order transition characterized by phase separation.

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Bandwidth controlled quantum phase transition between an easy-plane quantum spin Hall state and an s-wave superconductor

The quantum spin Hall state can be understood in terms of spontaneous O(3) symmetry breaking. Topological skyrmion configurations of the O(3) order parameter vector carry a charge 2e, and as shown previously, when they condense, a superconducting state is generated. We show that this topological route to superconductivity survives easy-plane anisotropy. Upon reducing the O(3) symmetry to O(2)$\times$ Z$_2$, skyrmions give way to merons that carry a unit charge. On the basis of large-scale auxiliary field quantum Monte Carlo simulations, we show that at the particle-hole symmetric point, we can trigger a continuous and direct transition between the quantum spin Hall state and s-wave superconductor by condensing pairs of merons. This statement is valid in both strong and weak anisotropy limits. Our results can be interpreted in terms of an easy-plane deconfined quantum critical point. However, in contrast to the previous studies in quantum spin models, our realization of this quantum critical point conserves $U(1)$ charge, such that skyrmions are conserved.

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Simulation of Fermionic and Bosonic Critical Points with Emergent SO(5) Symmetry

We introduce a model of Dirac fermions in 2+1 dimensions with a semimetallic, a quantum spin-Hall insulating (QSHI), and an s-wave superconducting (SSC) phase. The phase diagram features a multicritical point at which all three phases meet as well as a QSHI-SSC deconfined critical point. The QSHI and SSC orders correspond to mutually anti-commuting mass terms of the Dirac Hamiltonian. Based on this algebraic property, SO(5) symmetric field theories have been put forward to describe both types of critical points. Using quantum Monte Carlo simulations, we directly study the operator that rotates between QSHI and SSC states. The results suggest that it commutes with the low-energy effective Hamiltonian at criticality but has a gap in the ordered phases. This implies an emergent SO(5) symmetry at both the multicritical and the deconfined critical points.

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Thermodynamic and Dynamical Signatures of a Quantum Spin-Hall Insulator to Superconductor Transition

Thermodynamic and dynamical properties of a model of Dirac fermions with a deconfined quantum critical point (DQCP) separating an interaction-generated quantum spin-Hall insulator from an s-wave superconductor [Nature Comm.~{\bf 10}, 2658 (2019)] are studied by quantum Monte Carlo simulations. Inside the deconfined quantum critical region bound by the single-particle gap, spinons and spinless charge-2e skyrmions emerge. Since the model conserves total spin and charge, and has a single length scale, these excitations lead to a characteristic linear temperature dependence of the uniform spin and charge susceptibilities. At the DQCP, the order parameter dynamic structure factors show remarkable similarities that support emergent Lorentz symmetry. Above a critical temperature, superconductivity is destroyed by the proliferation of spin-1/2 vortices.

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Negative sign free formulations of generalized Kitaev models with higher symmetries

We provide a negative-sign-free formulation of the auxiliary field quantum Monte Carlo algorithm for generalized Kitaev models with higher symmetries. Our formulation is based on the Abrikosov fermion representation of the spin-1/2 degree of freedom and the phase pinning approach [Phys. Rev. B 104, L081106 (2021)]. Enhancing the number of fermion flavors or orbitals from one to $N$ allows one to generalize the inherent $Z_2$ global symmetry to Z$_2$$\times$SU($N$)$_o$. Using this general approach, we study the Z$_2$$\times$SU(2)$_o$ Kitaev-Heisenberg model reflecting the competition between the isotropic Heisenberg exchange and Kitaev-type bond-directional exchange interactions. We show that the symmetry enhancement provides a path to escape frustration and that the spin liquid phases in the original Z$_2$ symmetric model are not present in this model. Nevertheless, the ground-state phase diagram is extremely rich and has points with higher global and local continuous symmetries as well as de-confined quantum critical points.

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Doping-induced quantum spin Hall insulator to superconductor transition

A unique property of a dynamically generated quantum spin Hall state are Goldstone modes that correspond to the long-wavelength fluctuations of the spin-orbit coupling order parameter whose topological Skyrmion excitations carry charge 2$e$. Within the model considered here, upon varying the chemical potential, we observe two transitions: An s-wave superconducting order parameter develops at a critical chemical potential $μ_{c1}$, corresponding to the excitation gap of pairs of fermions, and at $μ_{c2}$ the SO(3) order parameter of the quantum spin Hall state vanishes. Using negative-sign-free, large-scale quantum Monte Carlo simulations, we show that $μ_{c1}=μ_{c2}$ within our accuracy -- we can resolve dopings away from half filling down to $δ= 0.0017$. The length scale associated with the fluctuations of the quantum spin Hall order parameter grows down to our lowest doping, suggesting either a continuous or a weakly first-order transition. Contrary to mean-field expectations, the doping versus chemical potential curve is not linear, indicating a dynamical critical exponent $z > 2$ if the transition is continuous.

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Gross-Neveu Heisenberg criticality: dynamical generation of quantum spin Hall masses

We consider fermions on a honeycomb lattice supplemented by a spin invariant interaction that dynamically generates a quantum spin Hall insulator. This lattice model provides an instance of Gross-Neveu Heisenberg criticality, as realized for example by the Hubbard model on the honeycomb lattice. Using auxiliary field quantum Monte Carlo simulations we show that we can compute with unprecedented precision susceptibilities of the order parameter. In O(N) Gross-Neveu transitions, the anomalous dimension of the bosonic mode grows as a function of N such that in the large-N limit it is of particular importance to consider susceptibilities rather than equal time correlations so as to minimize contributions from the background. For the N=3 case, we obtain $1/ν=1.11(4)$, $η_ϕ=0.80(9)$, and $η_ψ=0.29(2)$ for respectively the correlation length exponent, bosonic and fermionic anomalous dimensions.

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Quantum Monte Carlo Simulation of Generalized Kitaev Models

Frustrated spin systems generically suffer from the negative sign problem inherent to Monte Carlo methods. Since the severity of this problem is formulation dependent, optimization strategies can be put forward. We introduce a phase pinning approach in the realm of the auxiliary field quantum Monte Carlo algorithm. If we can find an anti-unitary operator that commutes with the one body Hamiltonian coupled to the auxiliary field, then the phase of the action is pinned to $0$ and $π$. For generalized Kitaev models, we can successfully apply this strategy and observe a remarkable improvement of the average sign. We use this method to study thermodynamical and dynamical properties of the Kitaev-Heisenberg model down to temperatures corresponding to half of the exchange coupling constant. Our dynamical data reveals finite temperature properties of ordered and spin-liquid phases inherent to this model.

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Topological terms on topological defects: a quantum Monte Carlo study

Dirac fermions in $2+1$ dimensions with dynamically generated anticommuting SO(3) antiferromagnetic (AFM) and Z$_2$ Kekulé valence-bond solid (KVBS) masses map onto a field theory with a topological $θ$-term. This term provides a mechanism for continuous phase transitions between different symmetry-broken states: topological defects of one phase carry the charge of the other and proliferate at the transition. The $θ$-term implies that a domain wall of the Z$_2$ KVBS order parameter harbors a spin-$1/2$ Heisenberg chain, as described by a $1+1$ dimensional SO(3) non-linear sigma model with $θ$-term at $θ= π$. Using pinning fields to stabilize the domain wall, we show that our auxiliary-field quantum Monte Carlo simulations indeed support the emergence of a spin-$1/2$ chain at the Z$_2$ topological defect. This concept can be generalized to higher dimensions where $2+1$ dimensional SO(4) or SO(5) theories with topological terms are realized at a domain wall.

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Mutual information in heavy-fermion systems

A key notion in heavy-fermion systems is the entanglement between conduction electrons and localized spin degrees of freedom. To study these systems from this point of view, we compute the mutual information in a ferromagnetic and antiferromagnetic Kondo lattice model in the presence of geometrical frustration. Here the interplay between the Kondo effect, the Ruderman-Kittel-Kasuya-Yosida interaction, and geometrical frustration leads to partial Kondo screened, conventional Kondo insulating, and antiferromagnetic phases. In each of these states the mutual information follows an area law, the coefficient of which shows sharp crossovers (on our finite lattices) across phase transitions. Deep in the respective phases, the area law coefficient can be understood in terms of simple direct product wave functions thereby yielding an accurate measure of the entanglement in each phase. The above-mentioned results stem from approximation-free auxiliary field quantum Monte Carlo simulations.

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