arXiv subjects

Jun Ishizuka

Publications and source records attributed to Jun Ishizuka.

At least 19 recordsLinked to original sources

arXiv2026

Field-angle dependence of magnetoresistance in UTe2

We theoretically study angle-resolved magnetoresistance under rotated magnetic field in the normal state of a spin-triplet superconductor UTe$_2$. The Wannier model derived from a GGA+$U$ calculation shows quasi-two-dimensional Fermi surfaces with warping in the $k_z$ direction, consistent with quantum oscillation measurements in the high magnetic field regime. Solving the semiclassical Boltzmann equation, we show that the Fermi surface geometry gives rise to oscillations in the magnetoresistance when the field is tilted from the $c$ axis toward the $a$ or $b$ axis. By assuming a band-dependent relaxation time, the calculated angle-resolved magnetoresistance is in good agreement with the recent transport experiment. This is direct evidence for the warped Fermi surface revealed by ordinary intraband transport. It suggests that the hole band with long relaxation time dominates electron transport. The field angle dependence of the Hall resistivity is calculated for further experimental verification.

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arXiv2026

Electron-Hole Scattering Dichotomy and Anisotropic Warping in Quasi-Two-Dimensional Fermi Surfaces of UTe2

We present a combined experimental and theoretical study of the detailed Fermi-surface (FS) geometry of UTe2, a heavy-fermion superconductor that has recently attracted considerable attention as a promising candidate for spin-triplet pairing. Using angle-dependent magnetoresistance oscillations, a bulk- and low-energy-sensitive transport probe for quasi-two-dimensional (Q2D) electronic structures, we directly determine the in-plane FS geometry. We found that the Q2D FS exhibits a rectangular cross-sectional shape with strongly anisotropic warping, originating from the hybridization of two orthogonal quasi-one-dimensional bands. Through a quantitative comparison between experiment and theoretical calculations, we further reveal a large electron-hole scattering dichotomy: the quasiparticle lifetime on the electron FS is substantially shorter than that on the hole FS. This dichotomy is naturally explained by anisotropic, low-dimensional antiferromagnetic fluctuations, which selectively enhance scattering on the electron FS. This suggests a dominant role of the electron pockets for the emergence of superconductivity. Our results clarify a direct relation between FS geometry, magnetic fluctuations, and momentum-dependent quasiparticle lifetimes, and thus providing a crucial basis for the microscopic understanding of pairing mechanism, and impose stringent constraints on the gap symmetry of spin-triplet superconductivity in UTe2.

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arXiv2024

Magnetic edge fields in UTe$_2$ near zero background fields

Chiral superconductors are theorized to exhibit spontaneous edge currents. Here, we found magnetic fields at the edges of UTe$_2$, a candidate odd-parity chiral superconductor, that seem to agree with predictions for a chiral order parameter. However, we did not detect the chiral domains that would be expected, and recent polar Kerr and muon spin relaxation data in nominally clean samples argue against chiral superconductivity. Our results show that hidden sources of magnetism must be carefully ruled out when using spontaneous edge currents to identify chiral superconductivity.

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arXiv2024

Correlation-induced Fermi surface evolution and topological crystalline superconductivity in CeRh2As2

Locally noncentrosymmetric structures in crystals are attracting much attention owing to emergent phenomena associated with the sublattice degree of freedom. The newly discovered heavy fermion superconductor CeRh$_2$As$_2$ is considered to be an excellent realization of this class. Angle-resolved photoemission spectroscopy experiments recently observed low-energy spectra of electron and hole bands and characteristic Van Hove singularities, stimulating us to explore the electronic correlation effect on the band structure. In this Letter, we theoretically study the electronic state and topological superconductivity from first principles. Owing to the Coulomb repulsion $U$ of Ce 4$f$ electrons, the low-energy band structure is modified in accordance with the experimental result. We show that Fermi surfaces change significantly from a complicated three-dimensional structure to a simple two-dimensional one. Fermi surface formulas for one-dimensional $\mathbb{Z}_2$ invariants in class D indicate topological crystalline superconductivity protected by the glide symmetry in a broad region for $U$. The classification of superconducting gap structure reveals topologically protected excitation gap and node. Our findings of the correlation-induced evolution of electronic structure provide a basis to clarify the unusual phase diagram of CeRh$_2$As$_2$ including superconductivity, magnetic order, and quadrupole density wave, and accelerate the search for topological superconductivity in strongly correlated electron systems.

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arXiv2023

Coexistence of near-EF flat band and van Hove singularity in a two-phase superconductor

In quantum many-body systems, particularly, the ones with large near-EF density states, like flat bands or van Hove singularity (VHS), electron correlations often give rise to rich phase diagrams with multiple coexisting/competing orders occurring at similar energy scales. The recently discovered locally noncentrosymmetric heavy fermion superconductor CeRh2As2 has stimulated extensive attention due to its unusual H-T phase diagram, consisting of two-phase superconductivity, antiferromagnetic order, and possible quadrupole-density wave orders. However, despite its great importance, the near-EF electronic structure remains experimentally elusive. Here, we provide this key information by combining soft X-ray and vacuum ultraviolet (VUV) angle-resolved photoemission spectroscopy measurements and atom-resolved DFT+U calculations. With bulk-sensitive soft X-rays, we reveal quasi-2D hole- and 3D electron- pockets with a pronounced nesting feature. Most importantly, we observe a symmetry-protected fourfold VHS coexisting with the Ce 4f flat bands near the EF, which, to the best of our knowledge, has never been reported before. Such a rare coexistence is expected to lead to a large density of states at the zone edge, enhancement in electron correlations, and a large upper critical field of the odd-parity superconducting phase. Uniquely, it will also result in a new type of f-VHS hybridization that alters the order and fine electronic structure of the symmetry-protected VHS and flat bands. These peculiarities offer important dimensions for understanding the reported rich phase diagram and are discussed as an origin of superconductivity with two phases. Our findings not only provide key insights into the nature of multiple phases in CeRh$_2$As$_2$, but also open up new prospects for exploring the novelties of many-body systems with f-VHS hybridization.

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arXiv2023

de Haas-van Alphen Oscillations for the Field Along c-axis in UTe2

We performed de Haas-van Alphen (dHvA) experiments in the spin-triplet superconductor UTe2 for magnetic field along the c-axis above 15T. Three fundamental dHvA frequencies, named alpha1, alpha2 and beta corresponding to the cross sections of cylindrical Fermi surfaces (FSs) with large cyclotron effective masses (33-43 m0) were detected. No other fundamental dHvA frequencies were detected at high frequency range, suggesting a cylindrical-shaped electron FS without connecting at the Z point of the Brillouin zone. However, the existence of small pocket FSs associated with extremely heavy masses cannot be fully excluded.

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arXiv2022

First Observation of de Haas-van Alphen Effect and Fermi Surfaces in Unconventional Superconductor UTe2

We report the first observation of the de Haas-van Alphen (dHvA) effect in the novel spin-triplet superconductor UTe2 using high quality single crystals with the high residual resistivity ratio (RRR) over 200. The dHvA frequencies, named alpha and beta, are detected for the field directions between c and a-axes. The frequency of branch beta increases rapidly with the field angle tilted from c to a-axis, while branch alpha splits, owing to the maximal and minimal cross-sectional areas from the same Fermi surface. Both dHvA branches, alpha and beta reveal two kinds of cylindrical Fermi surfaces with a strong corrugation at least for branch alpha. The angular dependence of the dHvA frequencies is in very good agreement with that calculated by the generalized gradient approximation (GGA) method taking into account the on-site Coulomb repulsion of U = 2 eV, indicating the main Fermi surfaces are experimentally detected. The detected cyclotron effective masses are large in the range from 32 to 57 m0 . They are approximately 10-20 times lager than the corresponding band masses, consistent with the mass enhancement obtained from the Sommerfeld coefficient and the calculated density of states at the Fermi level. The local density approximation (LDA) calculations of ThTe2 assuming U4+ with the 5f^2 localized model are in less agreement with our experimental results, in spite of the prediction for two cylindrical Fermi surfaces, suggesting a mixed valence states of U4+ and U3+ in UTe2.

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arXiv2022

Field-free superconducting diode effect in noncentrosymmetric superconductor/ferromagnet multilayers

The diode effect is fundamental to electronic devices and is widely used in rectifiers and AC-DC converters. At low temperatures, however, conventional semiconductor diodes possess a high resistivity, which yields energy loss and heating during operation. The superconducting diode effect (SDE), which relies on broken inversion symmetry in a superconductor may mitigate this obstacle: in one direction a zero-resistance supercurrent can flow through the diode, but for the opposite direction of current flow, the device enters the normal state with ohmic resistance. The application of a magnetic field can induce SDE in Nb/V/Ta superlattices with a polar structure, in superconducting devices with asymmetric patterning of pinning centres, or in superconductor/ferromagnet hybrid devices with induced vortices. The need for an external magnetic field limits their practical application. Recently, a field-free SDE was observed in a NbSe2/Nb3Br8/NbSe2 junction, and it originates from asymmetric Josephson tunneling that is induced by the Nb3Br8 barrier and the associated NbSe2/Nb3Br8 interfaces. Here, we present another implementation of zero-field SDE using noncentrosymmetric [Nb/V/Co/V/Ta]20 multilayers. The magnetic layers provide the necessary symmetry breaking and we can tune the SDE by adjusting the structural parameters, such as the constituent elements, film thickness, stacking order, and number of repetitions. We control the polarity of the SDE through the magnetization direction of the ferromagnetic layers. Artificially stacked structures, as the one used in this work, are of particular interest as they are compatible with microfabrication techniques and can be integrated with devices such as Josephson junctions. Energy-loss-free SDEs as presented in this work may therefore enable novel non-volatile memories and logic circuits with ultralow power consumption.

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arXiv2021

Superconductivity in monolayer FeSe enhanced by quantum geometry

We formulate the superfluid weight in unconventional superconductors with $\bm k$-dependent Cooper pair potentials based on the geometric properties of Bloch electrons. We apply the formula to a model of the monolayer FeSe obtained by the first-principles calculation. Our numerical calculations point to a significant enhancement of the Berezinskii-Kosterlitz-Thouless transition temperature due to the geometric contribution to the superfluid weight, which is not included in the Fermi liquid theory. The $\bm k$-dependence of the gap function also stabilizes the superconducting state. Our results reveal that the geometric properties of Bloch electrons play an essential role in superconducting materials and pave the way for clarifying hidden aspects of superconductivity from the viewpoint of quantum geometry.

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arXiv2021

Magnetic Properties under Pressure in Novel Spin-Triplet Superconductor UTe2

We report the magnetic susceptibility and the magnetization under pressures up to 1.7GPa above the critical pressure, Pc ~ 1.5GPa, for H // a, b, c-axes in the novel spin triplet superconductor UTe2. The anisotropic magnetic susceptibility at low pressure with the easy magnetization a-axis changes to the quasi-isotropic behavior at high pressure, revealing a rapid suppression of the susceptibility for a-axis, and a gradual increase of the susceptibility for the b-axis. At 1.7GPa above Pc, magnetic anomalies are detected at T_MO ~ 3K and T_WMO ~ 10K. The former anomaly corresponds to long-range magnetic order, most likely antiferromagnetism, while the latter shows a broad anomaly, which is probably due to the development of short range order. The unusual decrease and increase of the susceptibility below T_WMO for H // a and b-axes, respectively, indicate the complex magnetic properties at low temperatures above Pc. This is related to the interplay between multiple fluctuations dominated by antiferromagnetism, ferroamgnetism, valence and Fermi surface instabilities.

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arXiv2021

Topological crystalline superconductivity in locally noncentrosymmetric CeRh$_2$As$_2$

Recent discovery of superconductivity in CeRh$_2$As$_2$ clarified an unusual $H$-$T$ phase diagram with two superconducting phases [Khim et al. arXiv:2101.09522]. The experimental observation has been interpreted based on the even-odd parity transition characteristic of locally noncentrosymmetric superconductors. Indeed, the inversion symmetry is locally broken at the Ce site, and CeRh$_2$As$_2$ molds a new class of exotic superconductors. The low-temperature and high-field superconducting phase is a candidate for the odd-parity pair-density-wave state, suggesting a possibility of topological superconductivity as spin-triplet superconductors are. In this paper, we first derive the formula expressing the $\mathbb{Z}_2$ invariant of glide symmetric and time-reversal symmetry broken superconductors by the number of Fermi surfaces on a glide invariant line. Next, we conduct a first-principles calculation for the electronic structure of CeRh$_2$As$_2$. Combining the results, we show that the field-induced odd-parity superconducting phase of CeRh$_2$As$_2$ is a platform of topological crystalline superconductivity protected by the nonsymmorphic glide symmetry and accompanied by boundary Majorana fermions.

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arXiv2021

Periodic Anderson model for magnetism and superconductivity in UTe2

We provide and analyze a periodic Anderson model for studying magnetism and superconductivity in UTe$_2$, a recently-discovered candidate for a topological spin-triplet superconductor. The 24-band tight-binding model reproduces the band structure obtained from a DFT$+U$ calculation consistent with an angle-resolved photoemission spectroscopy. The Coulomb interaction of $f$-electrons enhances Ising ferromagnetic fluctuation along the $a$-axis and stabilizes spin-triplet superconductivity of either $B_{3u}$ or $A_{u}$ symmetry. When effects of pressure are taken into account in hopping integrals, the magnetic fluctuation changes to antiferromagnetic one, and accordingly spin-singlet superconductivity of $A_{g}$ symmetry is stabilized. Based on the results, we propose pressure-temperature and magnetic field-temperature phase diagrams revealing multiple superconducting phases as well as an antiferromagnetic phase. In particular, a mixed-parity superconducting state with spontaneous inversion symmetry breaking is predicted.

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arXiv2021

Thermodynamic electric quadrupole moments of nematic phases from first-principles calculation

The electronic nematic phase emerging with spontaneous rotation symmetry breaking is a central issue of modern condensed matter physics. In particular, various nematic phases in iron-based superconductors and high-$T_{\rm c}$ cuprate superconductors are extensively studied recently. Electric quadrupole moments (EQMs) are one of the order parameters characterizing these nematic phases in a unified way, and elucidating EQMs is a key to understanding these nematic phases. However, the quantum-mechanical formulation of the EQMs in crystals is a nontrivial issue because the position operators are non-periodic and unbound. Recently, the EQMs have been formulated by local thermodynamics, and such {\it thermodynamic EQMs} may be used to characterize the fourfold rotation symmetry breaking in materials. In this paper, we calculate the thermodynamic EQMs in iron-based superconductors LaFeAsO and FeSe as well as a cuprate superconductor La$_2$CuO$_4$ by a first-principles calculation. We show that owing to the orbital degeneracy the EQMs in iron-based superconductors are mainly determined by the geometric properties of wave functions. This result is in sharp contrast to the cuprate superconductor, in which the EQMs are dominated by distortion of the Fermi surface.

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arXiv2019

Insulator-metal transition and topological superconductivity in UTe2 from a first-principles calculation

We theoretically study superconductivity in UTe$_2$, which is a recently-discovered strong candidate for an odd-parity spin-triplet superconductor. Theoretical studies for this compound faced difficulty because first-principles calculations predict an insulating electronic state, incompatible with superconducting instability. To overcome this problem, we take into account electron correlation effects by a GGA$+U$ method and show the insulator-metal transition by Coulomb interaction. Using Fermi surfaces obtained as a function of $U$, we clarify topological properties of possible superconducting states. Fermi surface formulas for the three-dimensional winding number and three two-dimensional $\mathbb{Z}_2$ numbers indicate topological superconductivity at an intermediate $U$ for all the odd-parity pairing symmetry in the $Immm$ space group. Symmetry and topology of superconducting gap node are analyzed and the gap structure of UTe$_2$ is predicted. Topologically protected low-energy excitations are highlighted, and experiments by bulk and surface probes are proposed to link Fermi surfaces and pairing symmetry. Based on the results, we also discuss multiple superconducting phases under magnetic fields, which were implied by recent experiments.

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arXiv2018

Odd-parity multipole fluctuation and unconventional superconductivity in locally noncentrosymmetric crystal

A microscopic calculation and symmetry argument reveal superconductivity in the vicinity of parity-violating magnetic order. An augmented cluster magnetic multipole order in a crystal lacking local space inversion parity may break global inversion symmetry, and then, it is classified into an odd-parity multipole order. We investigate unconventional superconductivity induced by an odd-parity magnetic multipole fluctuation in a two-dimensional two-sublattice Hubbard model motivated by Sr$_2$IrO$_4$. We find that even-parity superconductivity is more significantly suppressed by a spin-orbit coupling than that in a globally noncentrosymmetric system. Consequently, two odd-parity superconducting states are stabilized by magnetic multipole fluctuations in a large spin-orbit coupling region. Both of them are identified as $Z_2$ topological superconducting states. The obtained gap function of inter-sublattice pairing shows a gapped/nodal structure protected by nonsymmorphic symmetry. Our finding implies a new family of odd-parity topological superconductors. Candidate materials are discussed.

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arXiv2017

Fermi surface, pressure-induced antiferromagnetic order, and superconductivity in FeSe

The pressure dependence of the structural ($T_s$), antiferromagnetic ($T_m$), and superconducting ($T_c$) transition temperatures in FeSe is investigated on the basis of the 16-band $d$-$p$ model. At ambient pressure, a shallow hole pocket disappears due to the correlation effect, as observed in the angular-resolved photoemission spectroscopy (ARPES) and quantum oscillation (QO) experiments, resulting in the suppression of the antiferromagnetic order, in contrast to the other iron pnictides. The orbital-polarization interaction between the Fe $d$ orbital and Se $p$ orbital is found to drive the ferro-orbital order responsible for the structural transition without accompanying the antiferromagnetic order. The pressure dependence of the Fermi surfaces is derived from the first-principles calculation and is found to well account for the opposite pressure dependences of $T_s$ and $T_m$, around which the enhanced orbital and magnetic fluctuations cause the double-dome structure of the eigenvalue $λ$ in the Eliashberg equation, as consistent with that of $T_c$ in FeSe.

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arXiv2015

Hole-$s_{\pm}$ State Induced by Coexisting Ferro- and Aniferromagnetic and Aniferro-orbital Fluctuations in the Iron Pnictides

The multi-orbital Hubbard model is investigated in order to clarify the electron correlation effects and the superconductivity in the iron-based superconductor. The renormalization effects on the self-energy and the two-particle irreducible vertex function are calculated on the basis of the dynamical mean field theory. We find that the vertex function exhibits a strong renormalization with the significant orbital dependence as compared with the renormalization factor, when the antiferromagnetic and the antiferro-orbital fluctuations are comparably enhanced due to the electron and the hole Fermi surfaces nesting effects. The orbital-dependent vertex function together with the $q\sim0$ nesting between the two-hole Fermi surfaces results in the inter-orbital ferromagnetic fluctuation gradually enhanced which is expected to be observed in LiFeAs. We show that the hole-$s_{\pm}$-wave superconductivity with the sign change of the two-hole Fermi surfaces is realized by the enhanced ferromagnetic fluctuation accompanied by the antiferromagnetic fluctuation and the antiferro-orbital fluctuation.

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arXiv2014

Metal-insulator transition and superconductivity in the two-orbital Hubbard-Holstein model for iron-based superconductors

We investigate a two-orbital model for iron-based superconductors to elucidate the effect of interplay between electron correlation and Jahn-Teller electron-phonon coupling by using the dynamical mean-field theory combined with the exact diagonalization method. When the intra- and inter-orbital Coulomb interactions, $U$ and $U'$, increase with $U=U'$, both the local spin and orbital susceptibilities, $χ_{s}$ and $χ_{o}$, increase with $χ_{s}=χ_{o}$ in the absence of the Hund's rule coupling $J$ and the electron-phonon coupling $g$. In the presence of $J$ and $g$, there are distinct two regimes: for $J \stackrel{>}{_\sim} 2g^2/ω_0$ with the phonon frequency $ω_0$, $χ_{s}$ is enhanced relative to $χ_{o}$ and shows a divergence at $J=J_c$ above which the system becomes Mott insulator, while for $J \stackrel{<}{_\sim} 2g^2/ω_0$, $χ_{o}$ is enhanced relative to $χ_{s}$ and shows a divergence at $g=g_c$ above which the system becomes bipolaronic insulator. In the former regime, the superconductivity is mediated by antiferromagnetic fluctuations enhanced due to Fermi-surface nesting and is found to be largely dependent on carrier doping. On the other hand, in the latter regime, the superconductivity is mediated by ferro-orbital fluctuations and is observed for wide doping region including heavily doped case without the Fermi-surface nesting.

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