arXiv subjects

Maiko Kofu

Publications and source records attributed to Maiko Kofu.

12 recordsLinked to original sources

arXiv2026

Coherent magnetic excitations in a topological Kondo semimetal

In Kondo insulators the many-body Kondo lattice effect drives the formation of bands containing heavy charge carriers with a hybridization gap, leading to insulating properties. These renormalized bands can host non-trivial topologies driven by strong electron-electron interactions, but probing narrow heavy bands at low temperatures is challenging. We use inelastic neutron scattering (INS) to probe the Kondo lattice CeNiSn, which hosts both semimetallic transport properties and a hybridization gap. The INS response exhibits momentum-dependent magnetic excitations and a spin-gap in the low-temperature Kondo coherent state, which electronic structure calculations corroborate as arising from the renormalized heavy band structure. Dynamical-mean field theory demonstrates that this renormalized band structure corresponds to a topological Kondo insulating state, and hence the INS probes bulk excitations of heavy topological bands. This identification of a Kondo insulator addresses the long-standing mystery of the electronic properties of CeNiSn, and demonstrates the manifestation of a topological many-body coherent state in spectroscopic measurements of strongly correlated narrow band materials.

cond-mat.str-el↗

arXiv2025

Ferroaxial order of the monolayer ice in martyite

Ice Ih, the most stable phase of water at ambient pressure, is a stacking of the honeycomb network of water molecules H2O. What if one layer of ice is exfoliated and confined to a two-dimensional (2D) sheet? Martyite Zn3(V2O7)(OH)2 2H2O, a mineral with the honeycomb lattice of H2O in the porous framework, is an ideal system for studying such monolayer ice. Due to the geometrical frustration and 2D nature, H2O molecules are dynamically disordered at room temperature. In this study, we reveal disorder-order transitions of H2O in martyite using single-crystal x-ray diffraction (XRD). The XRD results visualize the formation of hydrogen-bonded toroidal H2O hexamers, leading to the ferroaxial order below 200 K. Combined with the molecular dynamics simulations, we discuss the formation process of the H2O hexamers and how they compromise the molecular arrangement towards lower temperatures. Our results unveil the ground state of monolayer ice, a fundamental knowledge to understand the polymorphism of H2O.

cond-mat.mtrl-sci↗

arXiv2025

The influence of Structural Dynamics in Two-Dimensional Hybrid Organic-Inorganic Perovskites on their Photoluminescence Efficiency -- Neutron scattering analysis

Two-dimensional hybrid organic-inorganic perovskites (HOIPs) have emerged as promising materials for light-emitting diode applications. In this study, by using time-of-flight neutron spectroscopy we identified and quantitatively separated the lattice vibrational and molecular rotational dynamics of two perovskites, butylammonium lead iodide (BA)$_{2}$PbI$_{4}$ and phenethyl-ammonium lead iodide (PEA)$_{2}$PbI$_{4}$. By examining the corresponding temperature dependence, we found that the lattice vibrations, as evidenced by neutron spectra, are consistent with the lattice dynamics obtained from Raman scattering. We revealed that the rotational dynamics of organic molecules in these materials tend to suppress their photoluminescence quantum yield (PLQY) while the vibrational dynamics did not show predominant correlations with the same. Additionally, we observed photoluminescence emission peak splitting for both systems, which becomes prominent above certain critical temperatures where the suppression of PLQY begins. This study suggests that the rotational motions of polarized molecules may lead to a reduction in exciton binding energy or the breaking of degeneracy in exciton binding energy levels, enhancing non-radiative recombination rates, and consequently reducing photoluminescence yield. These findings offer a deeper understanding of fundamental interactions in 2D HOIPs and could guide the design of more efficient light-emitting materials for advanced technological applications.

cond-mat.mtrl-sci↗

arXiv2024

Three-dimensional spin susceptibility in Ba$_{0.75}$K$_{0.25}$Fe$_{2}$As$_{2}$: Out-of-plane modulation revealed by neutron spectroscopy and theoretical modeling

We present a combined experimental and theoretical investigation of the spin dynamics in the iron-based superconductor Ba$_{0.75}$K$_{0.25}$Fe$_2$As$_2$. Time-of-flight inelastic neutron scattering measurements reveal the three-dimensional (3D) nature of the spin fluctuations, manifested as out-of-plane modulations of the low-energy magnetic intensity. As the energy increases, this 3D-like modulation gradually fades away, leading to a more two-dimensional (2D) profile -- a clear signature of a 3D-to-2D crossover in the spin dynamics. By incorporating a realistic 3D electronic band structure derived from density functional theory (DFT), we reproduce the experimentally observed features of the spin susceptibility, including the pronounced out-of-plane modulation at low energies and its gradual evolution into a more 2D character at higher energies. The calculated susceptibility exhibits a peak at the experimental ordering wavevector $\mathbf{q}_{\mathrm{AFM}} = (0.5, 0.5, 1)$, demonstrating that the DFT-derived 3D model accurately captures the tendency toward out-of-plane antiferromagnetic (AFM) order. Notably, electronic states away from the Fermi level play a crucial role in shaping the susceptibility peak at $\mathbf{q}_{\mathrm{AFM}}$, highlighting the limitations of the Fermi surface nesting picture in explaining the out-of-plane AFM instability. The demonstrated agreement between experiment and theory serves as a benchmark for validating the DFT-derived model as a realistic description of the material-specific electronic structure.

cond-mat.supr-con↗

arXiv2024

Spin excitations arising from anisotropic Dirac spinons in YCu$_3$(OD)$_6$Br$_2$[Br$_{0.33}$(OD)$_{0.67}$]

A Dirac quantum spin liquid hosts Dirac spinons, which are low-energy fractionalized neutral quasiparticles with spin 1/2 that obey the Dirac equation. Recent inelastic neutron scattering studies have revealed a cone spin continuum in YCu$_3$(OD)$_6$Br$_2$[Br$_{x}$(OD)$_{1-x}$], consistent with the convolution of two Dirac spinons. In this work, we further studied spin excitations using the inelastic neutron scattering technique. The width of low-energy spin excitations shows a linear temperature dependence, which can be explained by spinon-spinon interactions with a Dirac dispersion. Polarized neutron scattering measurements reveal that in-plane magnetic fluctuations are about 1.5 times stronger than the out-of-plane ones, suggesting the presence of Dzyaloshinskii-Moriya interaction and consistent with our theoretical modeling and simulations. Moreover, the high-energy spin excitations around 14 meV agree with the one-pair spinon-antispinon excitations in Raman studies. The real part of the dynamical susceptibility derived from the Kramers-Kronig relationship also agrees with the Knight shift measured by nuclear magnetic resonance, clearly demonstrating the negligible effects of magnetic impurities on static susceptibility. These results provide a rare example in studying quantum-spin-liquid materials where different experimental techniques can be directly compared, and they give further insights for the possible Dirac quantum spin liquid in this system.

cond-mat.str-el↗

arXiv2024

Spectral evidence for Dirac spinons in a kagome lattice antiferromagnet

Emergent quasiparticles with a Dirac dispersion in condensed matter systems can be described by the Dirac equation for relativistic electrons, in analogy with Dirac particles in high-energy physics. For example, electrons with a Dirac dispersion have been intensively studied in electronic systems such as graphene and topological insulators. However, charge is not a prerequisite for Dirac fermions, and the emergence of Dirac fermions without charge degree of freedom has been theoretically predicted to be realized in Dirac quantum spin liquids. These quasiparticles carry a spin of 1/2 but are charge-neutral, and so are called spinons. Here we show that the spin excitations of a kagome antiferromagnet, YCu$_3$(OD)$_6$Br$_2$[Br$_{0.33}$(OD)$_{0.67}$], are conical with a spin continuum inside, which is consistent with the convolution of two Dirac spinons. The predictions of a Dirac spin liquid model with a spinon velocity obtained from the spectral measurements are in agreement with the low-temperature specific heat of the sample. Our results thus provide spectral evidence for the Dirac quantum spin liquid state emerging in this kagome lattice antiferromagnet. However, the locations of the conical spin excitations differ from those calculated by the nearest neighbor Heisenberg model, suggesting the Dirac spinons have an unexpected origin.

cond-mat.str-el↗

arXiv2024

Continuum of spin excitations in an ordered magnet

Continuum of spin excitations observed in inelastic neutron scattering experiments are often considered as a strong evidence of quantum spin liquid formation. When quantum spin liquid is indeed the ground state of a disorder-free magnetic compound, the elementary excitation is no longer the conventional spin waves (magnons). Instead, the magnons fractionalize into spinons, leaving only a two-spinon continuum detectable in inelastic neutron scattering experiments. For a clean ordered antiferromagnet, it was unclear if we can observe a continuous spectrum similar to the ones in a quantum spin liquid state. Here we show that the magnetically ordered state in Na$_2$BaCo(PO$_4$)$_2$ is able to host a spin excitation continuum induced by strong quantum fluctuations. Thus, a second thought is necessary when concluding such continuum as signature of quantum spin liquid in new material explorations.

cond-mat.str-el↗

arXiv2021

Dimensional reduction by geometrical frustration in a cubic antiferromagnet composed of tetrahedral clusters

Dimensionality is a critical factor in determining the properties of solids and is an apparent built-in character of the crystal structure. However, it can be an emergent and tunable property in geometrically frustrated spin systems. Here, we study the spin dynamics of the tetrahedral cluster antiferromagnet, pharmacosiderite, via muon spin resonance and neutron scattering. We find that the spin correlation exhibits a two-dimensional characteristic despite the isotropic connectivity of tetrahedral clusters made of spin 5/2 Fe3+ ions in the three-dimensional cubic crystal, which we ascribe to two-dimensionalisation by geometrical frustration based on spin wave calculations. Moreover, we suggest that even one-dimensionalisation occurs in the decoupled layers, generating low-energy and one-dimensional excitation modes, causing large spin fluctuation in the classical spin system. Pharmacosiderite facilitates studying the emergence of low-dimensionality and manipulating anisotropic responses arising from the dimensionality using an external magnetic field.

cond-mat.str-el↗

arXiv2021

Q-dependent Collective Relaxation Dynamics of Glass-Forming Liquid Ca0.4K0.6(NO3)1.4 Investigated by Wide-Angle Neutron Spin-Echo

Employing wide-angle neutron spin echo spectroscopy, we measured the Q-dependent coherent intermediate scattering function of the prototypical ionic glass former Ca0.4K0.6(NO3)1.4, in the equilibrium and supercooled liquid states beyond the hydrodynamic regime. The data reveal a clear two-step relaxation: an exponential fast process, and a stretched exponential slow alpha process. de Gennes narrowing is observed in all characteristic variables of the alpha process: the relaxation time, amplitude, and stretching exponent. At all length scales probed, the relative amplitude of the alpha-relaxation decreases with increasing temperature and levels off in the normal liquid state. The temperature dependence of the stretching exponent and the relaxation time at different Q's indicate that modifications of the relaxation mechanisms at the local length scales, manifested as temperature independent dynamic heterogeneity and smaller deviations from Arrhenius behavior, have occurred even above the alpha-beta (Johari-Goldstein) bifurcation temperature.

cond-mat.soft↗

arXiv2020

Temporally-decoherent and spatially-coherent vibrations in metal halide perovskite

The long carrier lifetime and defect tolerance in metal halide perovskites (MHPs) are major contributors to the superb performance of MHP optoelectronic devices. Large polarons were reported to be responsible for the long carrier lifetime. Yet microscopic mechanisms of the large polaron formation including the so-called phonon melting, are still under debate. Here, time-of-flight (TOF) inelastic neutron scattering (INS) experiments and first-principles density-functional theory (DFT) calculations were employed to investigate the lattice vibrations (or phonon dynamics) in methylammonium lead iodide ($\rm{MAPbI_3}$), a prototypical example of MHPs. Our findings are that optical phonons lose temporal coherence gradually with increasing temperature which vanishes at the orthorhombic-to-tetragonal structural phase transition. Surprisingly, however, we found that the spatial coherence is still retained throughout the decoherence process. We argue that the temporally decoherent and spatially coherent vibrations contribute to the formation of large polarons in this metal halide perovskite.

cond-mat.mtrl-sci↗

arXiv2020

Ultralow thermal conductivity from transverse acoustic phonon suppression in distorted crystalline α-MgAgSb

Low thermal conductivity is favorable for preserving the temperature gradient between the two ends of a thermoelectric material in order to ensure continuous electron current generation. In high-performance thermoelectric materials, there are two main low thermal conductivity mechanisms: the phonon anharmonic in PbTe and SnSe and phonon scattering resulting from the dynamic disorder in AgCrSe2 and CuCrSe2, which have been successfully revealed by inelastic neutron scattering. Using neutron scattering and ab initio calculations, we report here a mechanism of static local structure distortion combined with phonon-anharmonic-induced ultralow lattice thermal conductivity in α-MgAgSb. Since the transverse acoustic phonons are almost fully scattered by the compound's intrinsic distorted rocksalt sublattice, the heat is mainly transported by the longitudinal acoustic phonons. The ultralow thermal conductivity in α-MgAgSb is attributed to its atomic dynamics being altered by the structure distortion, which presents a possible microscopic route to enhance the performance of similar thermoelectric materials.

cond-mat.mtrl-sci↗

arXiv2019

Spin gap and L modulated intensity at the low-energy incommensurate magnetic fluctuations in the superconducting state of Sr2RuO4

Low-energy incommensurate (IC) magnetic fluctuations in the multiband superconductor Sr$_2$RuO$_4$ is investigated by high-resolution inelastic neutron scattering measurements and random phase approximation (RPA) calculations. Below $T_\text{c}$, the substantial spin gap is observed at $\mathbf{Q}_\text{IC}=(0.3, 0.3, L)$ where the quasi-one-dimensional $α$ and $β$ sheets consisting of the Fermi surfaces are in good nesting conditions. $L$ modulated intensity of the low-energy IC magnetic fluctuations and our RPA calculations indicate that the superconducting gaps regarding the $α$ and $β$ sheets have the horizontal line nodes.

cond-mat.supr-con↗