arXiv subjects

Seiichiro Onari

Publications and source records attributed to Seiichiro Onari.

At least 19 recordsLinked to original sources

arXiv2025

Microscopic origin of period-four stripe charge-density-wave in kagome metal CsV$_3$Sb$_5$

The interplay between unconventional density waves and exotic superconductivity has attracted growing interest. Kagome superconductors $A\rm{V}_3\rm{Sb}_5$ ($A = \rm{K}, \rm{Rb}, \rm{Cs}$) offer a platform for studying quantum phase transitions and the resulting symmetry breaking. Among these quantum phases, the $4a_0$ stripe charge-density-wave (CDW) has been widely observed for $A=\rm{Rb}$ and $\rm{Cs}$ by scanning tunneling microscopy (STM) and nuclear magnetic resonance (NMR) measurements. However, the microscopic origin of the $4a_0$ stripe CDW remains elusive, and no theoretical studies addressing this phenomenon have been reported so far. In this paper, we propose a microscopic mechanism for the emergence of the $4a_0$ stripe CDW. We analyze the CDW instability in the 12-site kagome lattice Hubbard model with the $2\times2$ bond order driven by the paramagnon-interference mechanism by focusing on the short-range magnetic fluctuations due to the geometrical frustration of kagome lattice. We reveal that the nesting vector of the reconstructed Fermi surface, formed by the $2\times 2$ bond order, gives rise to a $4a_0$-period CDW. Remarkably, the obtained stripe CDW is composed of both the off-site hopping integral modulations and on-site potentials. The real-space structure of the stripe CDW obtained here is in good qualitative agreement with the experimentally observed stripe pattern.

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arXiv2025

Impact of multiband effects on non-Fermi-liquid transport phenomena in bilayer nickelates

Recently discovered high-$T_c$ superconductivity in thin-film bilayer nickelates La$_3$Ni$_2$O$_7$ under ambient pressure has attracted great interest. Non-Fermi-liquid transport behaviors, such as $T$-linear resistivity and a positive Hall coefficient that increases at low temperatures, have been reported in this system. In this study, we analyze the non-Fermi-liquid transport phenomena in the thin-film bilayer nickelate La$_3$Ni$_2$O$_7$ using a multiorbital tight-binding model. In La$_3$Ni$_2$O$_7$, the cold spots composed of Ni $d_{x^2-y^2}$ orbital emerge, since the spin fluctuations cause stronger quasiparticle damping $\gamma$ in the Ni $d_{z^2}$ orbital. Notably, in the present study, we derive a rigorous formula for the Hall coefficient $R_H$ incorporating the $\gamma$ in the quasi-quantum metric (qQM) term. We find that the $T$ dependence of $\gamma$ in the qQM term is important in determining $R_H$. In La$_3$Ni$_2$O$_7$, the $T$ dependence of $R_H$ becomes pronounced due to the competition between the positive contribution from the hole band and the negative contribution from the electron band. Moreover, the qQM term plays an important role in describing the Nernst coefficient and other transport phenomena involving the second derivative velocity $v^{\mu\nu}$.

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arXiv2025

Unified mechanism of charge-density-wave and high-$T_c$ superconductivity protected from oxygen vacancies in bilayer nickelates

Unconventional charge and spin density-wave states are commonly observed in bilayer nickelates, drawing considerable attention due to their proximity to high-$T_c$ superconductivity in various phase diagrams. However, the nature and mechanisms of charge and spin density-waves (DWs) in nickelates remain poorly understood. Numerous experiments have reported that the charge-density-wave (CDW) transition temperature $T_{ cdw}$ and the spin-density-wave (SDW) transition temperature $T_{sdw}$ are closely related but distinct. However, in contrast to these experiments, previous mean-field-type analyses have yielded only a simple SDW phase. To resolve this key problem, this paper demonstrates that sizable CDW instabilities emerge in proportion to the SDW instability in La$3$Ni$2$O$7$.This behavior is driven by the paramagnon-interference (PMI) mechanism, which captures important electron correlations beyond mean-field theory. Therefore, (i) experimental CDW + SDW coexisting state is naturally explained. In addition, (ii) the CDW + SDW fluctuations cooperatively drive high-$T_c$ superconductivity. Notably, the predicted $s$-wave SC state is robust against the inner apical O vacancies. Furthermore, (iii) the CDW instability is highly sensitive to the size of the $d_{z^2}$-orbital hole pocket, allowing for the realization of CDW quantum criticality through carrier-doping and pressure application. We find that the coexistence of charge and spin fluctuations is essential in bilayer nickelates, with both playing a cooperative role in mediating high-$T_c$ superconductivity.

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arXiv2025

Origin of switchable quasiparticle-interference chirality in loop-current phase of kagome metals measured by scanning-tunneling-microscopy

In the kagome superconductors AV3Sb5 (A=Cs,Rb,K), a cascade of correlated electron phases cause exotic symmetry-breaking quantum states. In particular, the dissipationless chiral loop-current phase has been attracting increasing attention. A crucial clue is offered by the chirality of the quasiparticle interference signal observed in scanning tunneling microscopy. However, the connection between loop-current chirality and quasiparticle interference chirality remains poorly understood. Here, we reveal theoretically that a pronounced chiral quasiparticle interference signal emerges in the extremely dilute impurity regime ($lesssim$ 0.1 %). A single impurity at site Z induces a quasiparticle interference chirality $\chi_Z=\pm1$, determined by the direction of the Z3 nematicity, itself set by the relative position of the loop-current order in the star-of-David charge-density-wave phase. Notably, even a small magnetic field can smoothly switch the chirality, leading to field-induced shear lattice strain consistent with recent experiments. Our theoretical study provide key insights into the nature of the loop-current-induced symmetry-breaking states in kagome metals.

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arXiv2024

Non-Fermi-Liquid Transport Phenomena in Infinite-Layer Nickelates

Recently discovered superconducting infinite-layer nickelates $R$NiO$_2$ ($R$=Nd, La, Pr) attract increasing attention due to their similarities to cuprates. Both $R$NiO$_2$ and YBCO cuprates exhibit the non-Fermi-liquid transport behavior, characterized by resistivity proportional to temperature near the quantum critical point of the charge or spin density wave. In this study, we analyze the resistivity of infinite-layer nickelate Nd$_{0.85}$Sr$_{0.15}$NiO$_2$ based on a three-dimensional tight-binding model within the framework of the quasi-particle picture by applying linear response theory. We take account of the self-energy by the fluctuation-exchange approximation for the Ni orbital and the T-matrix approximation for an impurity effect on the Nd orbitals. We find that (i) the $T$-linear resistivity at low temperatures is derived from the spin fluctuations, and (ii) a negative and $T$-linear Seebeck coefficient is obtained. Therefore, NdNiO$_2$ behaves as a quasi-two-dimensional electron system, similar to CeCoIn$_5$.

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arXiv2024

Paramagnon-Interference Mechanism for Three-Dimensional Bond Order in Kagome Metals AV$_3$Sb$_5$ (A=Cs, Rb, K): Analysis by the Density-Wave Equation

The mechanism of CDW and its 3D structure are important fundamental issues in kagome metals. We have previously shown that, based on a 2D model, $2\times 2$ bond order (BO) emerges due to the paramagnon-interference (PMI) mechanism and that its fluctuations lead to $s$-wave superconductivity. This paper studies these issues based on realistic 3D models of kagome metals AV$_3$Sb$_5$ (A=Cs, Rb, K). We reveal that a commensurate 3D $2\times 2\times 2$ BO is caused by the PMI mechanism, by performing the 3D density-wave (DW) equation analysis for all A=Cs, Rb, K models in detail. Our results indicate a BO transition temperature $T_{\rm BO}\sim 100$K within the regime of moderate electron correlation. The 3D structure of BO is attributed to the three-dimensionality of the Fermi surface, while the 3D structure of BO is sensitively changed, since the Fermi surface is quasi-2D. Based on the analysis of the DW equation, by taking into account a finite third-order Ginzburg-Landau (GL) term, (i) shift stacking $2\times 2\times 2$ BO can be realized via a first-order transition below $T_{\rm BO}$. Here, the in-plane BO pattern (tri-hexagonal or star-of-David) is determined by the sign of the third-order GL term, with hole doping tending to favor the tri-hexagonal state. On the other hand, if the third-order GL term is very small, (ii) alternating vertical stacking BO may instead be realized via a second-order transition. The present study enhances our understanding of the rich variety of BOs observed experimentally. It is confirmed that the PMI mechanism is the essential origin of the 3D CDW of kagome metals.

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arXiv2024

Giant Impurity Effects on Charge Loop Current Order States in Kagome Metals

The exotic electronic states in the charge loop current (cLC) phase, in which the permanent charge current breaks the time-reversal symmetry, have been attracting increasing attention in recently discovered kagome metals AV3Sb5 (A = Cs, Rb, K). Interestingly, the cLC state is sensitively controlled by applying a small magnetic field as well as a tiny uniaxial strain. In addition, many experiments indicate that the cLC state is sensitive to the small number of impurities. To understand the impurity effects on the cLC electronic states accurately, we analyze the giant unit-cell (up to 1200 sites) kagome lattice model with single impurity potential. The loop current is found to be strongly suppressed within the current correlation length $\xi_J$ centered on the impurity site, where $\xi_J$ increases as the cLC order parameter $\eta$ decreases. (The cLC order is the pure imaginary hopping integral modulation $\delta t_{i,j}=\pm i\eta$.) In addition, both the uniform orbital magnetization $M_{orb}$ and the anomalous Hall conductivity $\sigma_{xy}$ are drastically suppressed by dilute impurities. Especially, the suppression ratio $R=-\Delta M_{orb}/M_{orb}^0$ can exceed 50% with the introduction of 1% impurities. Unexpectedly, the ratio $R$ is qualitatively insensitive to $\eta$, in highly contrast to a naive expectation that $R$ is proportional to the current suppression area $\pi \xi_J^2$. The resulting giant impurity effect of $M_{orb}$ would originates from the nonlocal contribution of the itinerant circulation of electrons. The present study gives a natural explanation of why the cLC electronic states in kagome metals are sensitive to dilute impurities.

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arXiv2023

Robust $T$-Linear Resistivity due to SU(4) Valley + Spin Fluctuation Mechanism in Magic Angle Twisted Bilayer Graphene

In the magic angle twisted bilayer graphene (MATBG), non-Fermi liquid like transport phenomena are universally observed. To understand their origin, we perform the self-consistent analysis of the self-energy due to SU(4) valley + spin fluctuations induced by the electron-electron correlation. In the SU(4) fluctuation mechanism, the fifteen channels of fluctuations contribute additively to the self-energy. Therefore, the SU(4) fluctuation mechanism gives much higher electrical resistance than the spin fluctuation mechanism. By the same reason, SU(4) fluctuations of intermediate strength provide $T$-linear resistivity down to $\sim1$K. Interestingly, the $T$-linear resistivity is robustly realizedfor wide range of electron filling, even away from the van-Hove filling. This study provides a strong evidence for the importance of electron-electron correlation in MATBG.

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arXiv2023

Real-space Loop Current Pattern in Time-reversal-symmetry Breaking Phase in Kagome Metals

The charge loop current (cLC) state has attracted increasing attention in kagome metals. Here, we calculate the spontaneous currents along the nearest sites $i$ and $j$, $J_{i,j}$, induced by the cLC order that is the imaginary and odd-parity hopping integral modulation $\delta t_{i,j}$. We reveal that the magnitude of $J_{i,j}$ strongly depends on the nearest sites $i$ and $j$ in the $2\times2$ cLC state, where $\eta\equiv |\delta t_{i,j}|$ is equivalent for all nearest sites. The obtained $J_{i,j}$ becomes large near the van-Hove singularity (vHS) filling ($n\sim n_{vHS}$) even when $\eta$ is fixed. Interestingly, the obtained $J_{i,j}$ exhibits the logarithmic divergence behavior at low temperatures for $n\sim n_{vHS}$ with a fixed $\eta$, by reflecting the vHS points that are the characteristic of kagome metals. The present study provides useful information for local electronic state measurements, such as the site-selective NMR and STM experiments.

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arXiv2023

Low temperature phase transitions under CDW state in kagome metals AV3Sb5 (A=Cs,Rb,K): Significance of mix-type Fermi surface electron correlations

To understand the multistage phase transitions in V-based kagome metals inside the charge-density-wave (CDW) phase, we focus on the impact of the "mix-type" Fermi surface because it is intact in the CDW state on the "pure-type" Fermi surface. On the mixed-type Fermi surface, moderate spin correlations develop, and we reveal that uniform (q=0) bond order is caused by the paramagnon interference mechanism, which is described by the Aslamazov-Larkin vertex correction. A dominant solution is the E2g-symmetry nematic order, in which the director can be rotated arbitrarily. In addition, we obtain the A1g-symmetry non-nematic order, which leads to the change in the lattice constants without symmetry breaking. The predicted E2g and A1g channel fluctuations at q=0 can be observed by the elastoresistance measurements. These results are useful to understand the multistage phase transitions inside the 2 $\times$ 2 CDW phase. The present theory has a general significance because mix-type band structure universally exists in various kagome lattice models.

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arXiv2022

Three-dimensional bond-order instability in infinite-layer nickelates due to nonlocal quantum interference

Recently discovered superconducting infinite-layer nickelates $R$NiO$_2$ ($R$=Nd, La, Pr) attracts increasing attention as a similar system to cuprates. Both $R$NiO$_2$ and YBCO cuprates display the three-dimensional (3D) CDW with wave vector ${\bf q}\sim(2\pi/3,0,q_z)$, while $q_z$ is non-zero and incommensurate in the former system. Here, we reveal that the characteristic CDW in $R$NiO$_2$ can be naturally explained as the quantum interference between paramagnons, by focusing on the following characteristics of $R$NiO$_2$: (i) prominent three-dimensionality in the Fermi surface and (ii) large self-hole-doping ($\sim 14$%). This mechanism predicts the emergence of the $d_{x^2-y^2}$-wave bond order at a secondary 3D nesting vector ${\bf q}^c\sim(2\pi/3,0,q^c_z)$ $(q^c_z=0.2\pi\sim 2\pi/3)$. The obtained strong bond fluctuations lead to the non-Fermi liquid electronic states and superconducting states in nickelates.

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arXiv2022

Unconventional density waves and superconductivities in Fe-based superconductors and other strongly correlated electron systems

To seek high-$T_c$ pairing mechanism, many scientists have focused on the mysterious spontaneous rotational symmetry breaking above Tc, such as nematic order at $q=0$ and smectic order at $q\ne0$. Such exotic correlation-driven symmetry breaking in metals has become a central issue in condensed matter physics. We demonstrate the emergence of the nematic and smectic orders due to orbital polarization ($n_{xz}\ne n_{yz}$) and the symmetry breaking in the correlated intersite hopping (= bond order $\delta t_{i,j}$) in Fe-based and cuprate superconductors. In addition, we discuss exotic spontaneous loop current orders driven by the pure imaginary $\delta t_{i,j}$. These interesting ``unconventional density-waves'' originate from the quantum interference between different spin fluctuations that is described by the vertex correction (VC) in the field theory. In the next stage, we discuss electron-correlation driven superconductivity due to the fluctuations of unconventional density-waves. For this purpose, we suggest the beyond-Migdal-Eliashberg gap equation by including the VCs into the equation. In Fe-based superconductors, high-$T_c$ $s$-wave superconductivity can be mediated by nematic and smectic fluctuations because the pairing interaction is magnified by the VCs. We also discuss the multipolar fluctuation pairing mechanism in heavy fermion systems, owing to the cooperation between the strong spin-orbit interaction and the strong electron correlation. To summarize, we suggest that the quantum interference mechanism described by the VCs is the key ingredients to explain not only various unconventional density-waves, but also exotic superconducting states in many strongly correlated metals. We finally discuss some interesting future issues with respect to the quantum interference mechanism.

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arXiv2022

A Rigorous Formalism of Unconventional Symmetry Breaking in Fermi Liquid Theory and Its Application to Nematicity in FeSe

Unconventional symmetry breaking due to nonlocal order parameters has attracted considerable attention in many strongly correlated metals. Famous examples are the nematic order in Fe-based superconductors and the star-of-David charge density order in kagome metals. Such exotic symmetry breaking in metals is a central issue of modern condensed matter physics, while its theoretical foundation is still unclear in comparison with the well-established theory of superconductivity. To overcome this difficulty, here we introduce the "form factor" that generalizes the nonlocal order parameter into the Luttinger-Ward (LW) Fermi liquid theory. We then construct a rigorous formalism of the "density-wave equation" that gives the thermodynamically stable form factor, similarly to the superconducting-gap equation. In addition, a rigorous expression of the Ginzburg-Landau free-energy for the unconventional order is presented to calculate various thermodynamic properties. In the next stage, we apply the derived formalism to a typical Fe-based superconductor FeSe, by using the one-loop LW function that represents the free-energy gain due to the interference among paramagnons. The following key experiments are naturally explained: (i) Lifshitz transition (=disappearance of an electron-pocket) due to the bond+orbital order below $T_c$. (ii) Curie-Weiss behavior of the nematic susceptibility at higher T, and the deviation from the Curie-Weiss behavior at lower T near the nematic quantum-critical-point. (iii) Scaling relation of the specific heat jump at $T_c$, $\Delta C/T_c \propto T_c^b$ with $b \sim 3$. (Note that b=0 in the BCS theory.) These results lead to a conclusion that the nematicity in FeSe is the bond+orbital order due to the "paramagnon interference mechanism". The present theory paves the way for solving various unconventional phase transition systems.

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arXiv2022

Diverse Exotic Orders and Fermiology in Fe-based Superconductors: A Unified Mechanism for $B_{1g}/B_{2g}$ Nematicity in FeSe/(Cs,Rb)Fe$_2$As$_2$ and Smectic Order in BaFe$_2$As$_2$

A rich variety of nematic/smectic orders in Fe-based superconductors is an important unsolved problem in strongly correlated electron systems. A unified understanding of these orders has been investigated for the last decade. In this article, we explain the $B_{1g}$ symmetry nematic transition in FeSe$_{1-x}$Te$_x$, the $B_{2g}$ symmetry nematicity in AFe$_2$As$_2$ (A=Cs, Rb), and the smectic state in BaFe$_2$As$_2$ based on the same framework. We investigate the quantum interference mechanism between spin fluctuations by developing the density wave equation. The observed rich variety of nematic/smectic orders is naturally understood in this mechanism. The nematic/smectic orders depend on the characteristic shape and topology of the Fermi surface (FS) of each compound. (i) In FeSe$_{1-x}$Te$_x$, each FS is very small and the dxy-orbital hole pocket is below the Fermi level. In this case, the small spin fluctuations on three dxz, dyz, and dxy orbitals cooperatively lead to the $B_{1g}$ nematic order. The experimental Lifshitz transition below the nematic transition temperature $(T_S)$ is naturally reproduced. (ii) In BaFe$_2$As$_2$, the dxy-orbital hole pocket emerges around M point, and each FS is relatively large. The strong spin fluctuations due to the dxy-orbital nesting give rise to the $B_{1g}$ nematic order and the smectic order, and the latter transition temperature ($T^*$) exceeds the former one $T_S$. (iii) In heavily hole-doped AFe$_2$As$_2$, the large dxy-orbital hole pocket and the four tiny Dirac pockets appear due to the hole-doping. The $B_{2g}$ nematic bond order emerges on the dxy-orbital hole pocket due to the same interference mechanism. The present paramagnon interference mechanism provides a unified explanation of why the variety of nematic/smectic orders in Fe-based superconductors is so rich, based on the well-established fermiology of Fe-based superconductors.

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arXiv2021

Mechanism of exotic density-wave and beyond-Migdal unconventional superconductivity in kagome metal AV3Sb5 (A=K, Rb, Cs)

Exotic quantum phase transitions in metals, such as the nematic and smectic states, were discovered one after another and found to be universal now. The emergence of unconventional density-wave order in frustrated kagome metal AV$_3$Sb$_5$ and its interplay with exotic superconductivity attract increasing attention. We reveal that the smectic bond-density-wave is naturally caused by the paramagnon interference mechanism, because strong scatterings among different van-Hove singularity points are induced. In addition, the fluctuations of the bond-order induce sizable "beyond-Migdal" pairing glue, and therefore both singlet nodal $s$-wave pairing and triplet $p$-wave pairing states are expected to emerge. The coexistence of both states would explain exotic superconducting states. Unexpected similarities between kagome metal and some Fe-based superconductors are discussed. This study enables us to understand the exotic density wave, superconductivity and their interplay in kagome metals based on the interference mechanism.

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arXiv2021

Development of spin fluctuations under the presence of $d$-wave bond order in cuprate superconductors

In cuprate superconductors, superconductivity appears below the CDW transition temperature $T_{CDW}$. However, many-body electronic states under the CDW order are still far from understood. Here, we study the development of the spin fluctuations under the presence of $d$-wave bond order (BO) with wavevector $q=(\pi/2,0),(0,\pi/2)$, which is derived from the paramagnon interference mechanism in recent theoretical studies. Based on the $4 \times 1$ and $4 \times 4$ cluster Hubbard models, the feedback effects between spin susceptibility and self-energy are calculated self-consistently by using the fluctuation-exchange (FLEX) approximation. It is found that the $d$-wave BO leads to a sizable suppression of the nuclear magnetic relaxation rate $1/T_1$. In contrast, the reduction in $T_c$ is small, since the static susceptibility $\chi^s(Q_s)$ is affected by the BO just slightly. It is verified that the $d$-wave BO scenario is consistent with the experimental electronic properties below $T_{CDW}$.

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arXiv2020

Unconventional orbital-charge density wave mechanism in transition metal dichalcogenide 1T-TaS2

The transition metal dichalcogenide 1T-TaS2 attract growing attention because of the formation of rich density-wave (DW) and superconducting transitions. However, the origin of the incommensurate DW state at the highest temperature (~ 550 K), which is "the parent state" of the rich physical phenomena, is still uncovered. Here, we present a natural explanation for the triple-q incommensurate DW in 1T-TaS2 based on the first-principles Hubbard model with on-site U. We apply the paramagnon interference mechanism that gives the nematic order in Fe-based superconductors. The derived order parameter has very unique characters: (i) the orbital-selective nature, and (ii) the unconventional sign-reversal in both momentum and energy spaces. The present study will be useful for understanding rich physics in 1T-TaS2, 1T-VSe2, and other transition metal dichalcogenides.

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arXiv2020

$SU(4)$ Valley + Spin Fluctuation Interference Mechanism for Nematic Order in Magic Angle Twisted Bilayer Graphene: Impact of Vertex Corrections

In the magic angle twisted bilayer graphene (MATBG), one of the most remarkable observations is the $C_3$-symmetry-breaking nematic state. We identify that the nematicity in MATBG is the $E$-symmetry ferro bond order, which is the modulation of correlated hopping integrals owing to the $E$-symmetry particle-hole pairing condensation. The nematicity in MATBG originates from prominent quantum interference among $SU(4)$ valley+spin composite fluctuations. This novel "valley + spin fluctuation interference mechanism" is revealed by the density wave equation analysis for realistic multiorbital Hubbard model for MATBG. \color{black}We find that the nematic state is robust once three van Hove singularity points exist in each valley. This interference mechanism also causes novel time-reversal-symmetry-broken valley polarization accompanied by a charge loop current. We discuss interesting similarities and differences between MATBG and Fe-based superconductors.

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