We present a systematic method to automatically generate symmetry-adapted magnetic structures for given crystal structure and general propagation vector k as an efficient approach of the analysis of complex modulated magnetic structures. The method is developed as an extension of the generation scheme based on multipole expansion, which was demonstrated only for the propagation vector k=0 [M.-T. Suzuki et al., Phys. Rev. B 99, 174407 (2019)]. The symmetry-adapted magnetic structures characterized with an ordering vector k are obtained by mapping the multipole magnetic alignments on a virtual cluster to the periodic crystal structure with the phase factor for the wave vector k. This method provides all magnetic bases compatible with irreducible representations under k-group for given crystal structure and wave vector k. Multiple-k magnetic structures are derived from superposition of single-k magnetic bases related with space group symmetry. We apply the scheme to deduce the magnetic structures of $α$-Mn and Co$M_{3}$S$_6$ (M = Nb, Ta), in which large anomalous Hall effect has recently been observed in antiferromagnetic phases, and identify the magnetic structures inducing anomalous Hall effect without net magnetization. The physical phenomena originating from emergent multipoles in the ordered phases are also discussed based on the Landau theory.
Matrix product state classification of 1D multipole symmetry protected topological phases
Yukawa Institute for Theoretical Physics, Kyoto University（京都大学汤川理论物理研究所）；Center for Quantum Mathematics at IMADA, Southern Denmark University（南丹麦大学IMADA量子数学中心）；Niels Bohr International Academy, Niels Bohr Institute, University of Copenhagen（哥本哈根大学尼尔斯玻尔研究所尼尔斯玻尔国际学院）；Institute for Theoretical Physics, University of Cologne（科隆大学理论物理研究所）；Interdisciplinary Theoretical and Mathematical Sciences Program (iTHEMS) RIKEN（理化学研究所交叉理论与数学科学项目(iTHEMS)）
We propose an efficient microscopic design procedure of electronic band structures having intrinsic spin and momentum dependences in spin-orbit-coupling free antiferromagnets. Our bottom-up design approach to creating desired spin-split and reshaped band structures could result in further findings of practical spin-orbit-coupling free materials exhibiting a giant spin-dependent and/or nonreciprocal transport, magneto-electric and elastic responses as a consequence of such band structures. We establish a systematic guideline to construct symmetric/antisymmetric spin-split and antisymmetrically …
The optical Hall response is theoretically studied for spin-orbit coupled metals with ferroic orders of cluster-type magnetic multipoles. We find that different magnetic multipoles give rise to distinct spectra in the optical Hall conductivity. In the cases of monopole and quadrupole orders, the optical Hall response appears predominantly in high- and low-energy regions, which correspond to the energy scales of electron correlation and kinetic energy, respectively, while the response is dispersed and rather weak in the case of toroidal order. By decomposing the spectra into different interband…
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 constan…
We introduce a cluster extension of multipole moments to discuss the anomalous Hall effect (AHE) in both ferromagnetic (FM) and antiferromagnetic (AFM) states in a unified framework. We first derive general symmetry requirements for the AHE in the presence or absence of the spin-orbit coupling, by considering the symmetry of the Berry curvature in k space. The cluster multipole (CMP) moments are then defined to quantify the macroscopic magnetization in non-collinear AFM states, as a natural generalization of the magnetization in FM states. We identify the macroscopic CMP order which induces th…
Odd-Parity Crystalline Electric Field and Multipoles in Icosahedral Quasicrystal and Approximant: Magnetic Toroidal and Electric Dipoles in Ce-Based Systems
Kyushu Institute of Technology（九州工业大学）；Yokohama National University（横滨国立大学）
The microscopic conditions for the emergence of nonreciprocal magnon excitations in noncentrosymmetric magnets are theoretically investigated. We show that asymmetric magnon excitations appear when a bond magnetic toroidal dipole becomes active, which is defined as a parallel component between the Dzyaloshinskii-Moriya vector and the averaged spin moments at the ends of the bonds. Depending on magnetic structures accompanying the bond magnetic toroidal dipoles, the higher-rank magnetic toroidal multipoles can also be activated in a magnetic cluster, which describes various angle dependences of…
In vortex-like spin arrangements, multiple spins can combine into emergent multipole moments. Such multipole moments have broken space-inversion and time-reversal symmetries, and can therefore exhibit linear magnetoelectric (ME) activity. Three types of such multipole moments are known: toroidal, monopole, and quadrupole moments. So far, however, the ME-activity of these multipole moments has only been established experimentally for the toroidal moment. Here, we propose a magnetic square cupola cluster, in which four corner-sharing square-coordinated metal-ligand fragments form a noncoplanar b…
The multipole concept, which characterizes the spacial distribution of scalar and vector objects by their angular dependence, has already become widely used in various areas of physics. In recent years it has become employed to systematically classify the anisotropic distribution of electrons and magnetization around atoms in solid state materials. This has been fuelled by the discovery of several physical phenomena that exhibit unusual higher rank multipole moments, beyond that of the conventional degrees of freedom as charge and magnetic dipole moment. Moreover, the higher rank electric/magn…
Odd-parity magnetic and magnetic toroidal multipoles in the absence of both spatial-inversion and time-reversal symmetries are sources of multiferroic and nonreciprocal optical phenomena. We investigate electronic states caused by an emergent odd-parity magnetic quadrupole (MQ) as a representative example of magnetic odd-parity multipoles. It is shown that spontaneous ordering of the MQ leads to an antisymmetric spin-orbital polarization in momentum space, which corresponds to a spin-orbital momentum locking at each wave vector. By symmetry argument, we show that the orbital or sublattice degr…
A formation of tetrahedral spin clusters is discovered by Monte Carlo simulation for a spin-ice type double-exchange model on a pyrochlore lattice. The spin-cluster phase is magnetically disordered, but breaks spatial inversion symmetry spontaneously by developing noncoplanar four-spin molecules periodically on the pyrochlore lattice. We find that the system exhibits a nonzero spin Hall conductivity in the spin-cluster phase. The result suggests that an intersite-multipole order induces the unconventional spin Hall state without the spin-orbit interaction.
Institute for Condensed Matter Theory, University of Illinois Urbana-Champaign（伊利诺伊大学厄巴纳-香槟分校凝聚态理论研究所）；Max Planck Institute for the Physics of Complex Systems（马克斯·普朗克复杂系统物理研究所）；CeFEMA-LaPMET, Departamento de Física, Instituto Superior Técnico, Universidade de Lisboa（里斯本大学高等技术学院物理系CeFEMA-LaPMET）
