arXiv subjects

E. Dagotto

Publications and source records attributed to E. Dagotto.

At least 19 recordsLinked to original sources

arXiv2025

Magnon damping and mode softening in quantum double-exchange ferromagnets

We present a comprehensive analysis of the magnetic excitations and electronic properties of fully quantum double-exchange ferromagnets, i.e., systems where ferromagnetic ordering emerges from the competition between spin, charge, and orbital degrees of freedom, but without the canonical approximation of using classical localized spins. Specifically, we investigate spin excitations within the Kondo lattice-like model, as well as a two-orbital Hubbard Hamiltonian in proximity to the orbital-selective Mott phase. Computational analysis of the magnon dispersion, damping, and spectral weight within these models reveals unexpected phenomena, such as magnon mode softening and the anomalous decoherence of magnetic excitations as observed in earlier experimental efforts, but explained here without the use of the phononic degrees of freedom. We show that these effects are intrinsically linked to incoherent spectral features near the Fermi level, which arise due to the quantum nature of the local (on-site) triplets. This incoherent spectrum leads to a Stoner-like continuum on which spin excitations scatter, governing magnon lifetime and strongly influencing the dynamical spin structure factor. Our study explores the transition from coherent to incoherent magnon spectra by varying the electron density. Furthermore, we demonstrate that the magnitude of the localized spin mitigates decoherence by suppressing the incoherent spectral contributions near the Fermi level. We also discuss the effective $J_1$-$J_2$ spin Hamiltonian, which can accurately describe the large doping region characterized by the magnon-mode softening. Finally, we show that this behavior is also present in multiorbital models with partially filled orbitals, namely, in systems without localized spin moments, provided that the model is in a strong coupling regime.

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arXiv2025

Cooper-Pair Localization in the Magnetic Dynamics of a Cuprate Ladder

We investigate the spin dynamics of the cuprate ladder Sr$_{2.5}$Ca$_{11.5}$Cu$_{24}$O$_{41}$ to elucidate the behavior of its intrinsically doped holes. Combining high-resolution neutron spectroscopy and density matrix renormalization group calculations enables a comprehensive analysis of the collective magnetic dynamics. We find a general absence of magnetic signatures from unpaired charges, indicating holes within the system form strongly bound localized Cooper pairs. A one-band Hubbard model fails to match the spectral features but a straightforward extension to a large attractive nearest-neighbor interaction quantitatively explains our results. Our finding shows the significance of additional interactions beyond the long-predicted quantum spin pairing in the ($d$-wave) charge pairing process. Considering the parallels between ladders and two-dimensional cuprates, these results are potentially relevant for square lattices as well.

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arXiv2024

Evidence for valence-bond pairing in a one-dimensional two-orbital system

Valence bond (VB) states as the formation mechanism of Cooper pairs, eventually leading to high-temperature superconductivity, remain a controversial topic. Although various VB-like states find variational relevance in the description of specific spin models and quantum spin liquids, in the realm of many-body fermionic Hamiltonians, the evidence for such states as ground states wave functions remains elusive, challenging the valence-bond pairing mechanism. Here, we present evidence of a VB ground state with pairing tendencies, particularly at finite doping. We achieved this for the generic two-orbital Hubbard model in low dimension, where the VB states can be associated with the presence of the topological order manifested by edge states.

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arXiv2024

Spectrum and low-temperature bulk properties of triangular quantum spin liquid candidate NaYbSe$_2$

We report neutron scattering, pressure-dependent AC calorimetry, and AC magnetic susceptibility measurements of triangular lattice NaYbSe$_2$. We observe a continuum of scattering, which is reproduced by matrix product simulations, and no phase transition is detected in any bulk measurements. Comparison to heat capacity simulations suggest the material is within the Heisenberg spin liquid phase. AC Susceptibility shows a frequency-dependent peak at 40 mK, as has been observed in several triangular magnets.

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arXiv2023

Transition to the Haldane phase driven by electron-electron correlations

One of the most famous quantum systems with topological properties, the spin $\mathcal{S}=1$ antiferromagnetic Heisenberg chain, is well-known to display exotic $\mathcal{S}=1/2$ edge states. However, this spin model has not been analyzed from the more general perspective of strongly correlated systems varying the electron-electron interaction strength. Here, we report the investigation of the emergence of the Haldane edge in a system of interacting electrons -- the two-orbital Hubbard model -- with increasing repulsion strength $U$ and Hund interaction $J_\mathrm{H}$. We show that interactions not only form the magnetic moments but also form a topologically nontrivial fermionic many-body ground-state with zero-energy edge states. Specifically, upon increasing the strength of the Hubbard repulsion and Hund exchange, we identify a sharp transition point separating topologically trivial and nontrivial ground-states. Surprisingly, such a behaviour appears already at rather small values of the interaction, in a regime where the magnetic moments are barely developed.

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arXiv2023

Hund bands in spectra of multiorbital systems

Spectroscopy experiments are routinely used to characterize the behavior of strongly correlated systems. An in-depth understanding of the different spectral features is thus essential. Here, we show that the spectrum of the multiorbital Hubbard model exhibits unique Hund \ms{bands} that occur at energies given only by the Hund coupling $J_\mathrm{H}$, as distinct from the Hubbard satellites following the interaction $U$. We focus on experimentally relevant single-particle and optical spectra that we calculate for a model related to iron chalcogenide ladders. The calculations are performed via the density-matrix renormalization group and Lanczos methods. The generality of the implications is verified by considering a generic multiorbital model within dynamical mean-field theory.

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arXiv2021

Anomalous Magnetoresistance by Breaking Ice Rule in Bi2Ir2O7/Dy2Ti2O7 Heterostructure

While geometrically frustrated quantum magnets are known for a variety of exotic spin states that are of great interests of understanding emergent phenomena as well as enabling revolutionary quantum technologies, most of them are necessarily good insulators which are difficult to be integrated with modern electrical circuit that relies on moving charge carriers. The grand challenge of converting fluctuations and excitations of frustrated moments into electronic responses is finding ways to introduce charge carriers that interact with the localized spins without destroying the spin states. Here, we show that, by designing a Bi2Ir2O7/Dy2Ti2O7 heterostructure, the breaking of the spin ice rule in insulating Dy2Ti2O7 can lead to a charge response in the Bi2Ir2O7 conducting layer that can be detected as anomalous magnetoresistance. These results demonstrate a novel and feasible interfacial approach for electronically probing exotic spin states in insulating magnets, laying out a blueprint for the metallization of frustrated quantum magnets.

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arXiv2021

Interaction-induced topological phase transition and Majorana edge states in low-dimensional orbital-selective Mott insulators

Topological phases of matter are among the most intriguing research directions in Condensed Matter Physics. It is known that superconductivity induced on a topological insulator's surface can lead to exotic Majorana modes, the main ingredient of many proposed quantum computation schemes. In this context, the iron-based high critical temperature superconductors are a promising platform to host such an exotic phenomenon in real condensed-matter compounds. The Coulomb interaction is commonly believed to be vital for the magnetic and superconducting properties of these systems. This work bridges these two perspectives and shows that the Coulomb interaction can also drive a canonical superconductor with orbital degrees of freedom into the topological state. Namely, we show that above a critical value of the Hubbard interaction the system simultaneously develops spiral spin order, a highly unusual triplet amplitude in superconductivity, and, remarkably, Majorana fermions at the edges of the system.

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arXiv2020

Block orbital-selective Mott insulators: a spin excitation analysis

We present a comprehensive study of the spin excitations - as measured by the dynamical spin structure factor $S(q,ω)$ - of the so-called block-magnetic state of low-dimensional orbital-selective Mott insulators. We realize this state via both a multi-orbital Hubbard model and a generalized Kondo-Heisenberg Hamiltonian. Due to various competing energy scales present in the models, the system develops periodic ferromagnetic islands of various shapes and sizes, which are antiferromagnetically coupled. The 2$\times$2 particular case was already found experimentally in the ladder material BaFe$_2$Se$_3$ that becomes superconducting under pressure. Here we discuss the electronic density as well as Hubbard and Hund coupling dependence of $S(q,ω)$ using density matrix renormalization group method. Several interesting features were identified: (1) An acoustic (dispersive spin-wave) mode develops. (2) The spin-wave bandwidth establishes a new energy scale that is strongly dependent on the size of the magnetic island and becomes abnormally small for large clusters. (3) Optical (dispersionless spin excitation) modes are present for all block states studied here. In addition, a variety of phenomenological spin Hamiltonians have been investigated but none matches entirely our results that were obtained primarily at intermediate Hubbard $U$ strengths. Our comprehensive analysis provides theoretical guidance and motivation to crystal growers to search for appropriate candidate materials to realize the block states, and to neutron scattering experimentalists to confirm the exotic dynamical magnetic properties unveiled here, with a rich mixture of acoustic and optical features.

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arXiv2020

Block-spiral magnetism: An exotic type of frustrated order

Competing interactions in Quantum Materials induce novel states of matter such as frustrated magnets, an extensive field of research both from the theoretical and experimental perspectives. Here, we show that competing energy scales present in the low-dimensional orbital-selective Mott phase (OSMP) induce an exotic magnetic order, never reported before. Earlier neutron scattering experiments on iron-based 123 ladder materials, where OSMP is relevant, already confirmed our previous theoretical prediction of block-magnetism (magnetic order of the form $\uparrow\uparrow\downarrow\downarrow$). Now we argue that another novel phase can be stabilized in multi-orbital Hubbard models, the {\it block-spiral state}. In this state, the magnetic islands form a spiral propagating through the chain but with the blocks maintaining their identity, namely rigidly rotating. This new spiral state is stabilized without any apparent frustration, the common avenue to generate spiral arrangements in multiferroics. By examining the behaviour of the electronic degrees of freedom, parity breaking quasiparticles are revealed. Finally, a simple phenomenological model that accurately captures the macroscopic spin spiral arrangement is also introduced, and fingerprints for the neutron scattering experimental detection of our new state are provided.

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arXiv2019

Novel Magnetic Block States in Low-Dimensional Iron-Based Superconductors

Inelastic neutron scattering recently confirmed the theoretical prediction of a $\uparrow\uparrow\downarrow\downarrow$-magnetic state along the legs of quasi-one-dimensional (quasi-1D) iron-based ladders in the orbital-selective Mott phase (OSMP). We show here that electron-doping of the OSMP induces a whole class of novel block-states with a variety of periodicities beyond the previously reported $π/2$ pattern. We discuss the magnetic phase diagram of the OSMP regime that could be tested by neutrons once appropriate quasi-1D quantum materials with the appropriate dopings are identified.

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arXiv2018

Spin dynamics of the block orbital-selective Mott phase

Iron-based superconductors display a variety of magnetic phases originating in the competition between electronic, orbital, and spin degrees of freedom. Previous theoretical investigations of the multi-orbital Hubbard model in one dimension revealed the existence of an orbital-selective Mott phase (OSMP) with block spin order. Recent inelastic neutron scattering (INS) experiments on the BaFe$_2$Se$_3$ ladder compound confirmed the relevance of the block-OSMP. Moreover, the powder INS spectrum reveled an unexpected structure, containing both low-energy acoustic and high-energy optical modes. Here we present the theoretical prediction for the dynamical spin structure factor within a block-OSMP regime using the density-matrix renormalization group method. In agreement with experiments we find two dominant features: low-energy dispersive and high-energy dispersionless modes. We argue that the former represents the spin-wave-like dynamics of the block ferromagnetic islands, while the latter is attributed to a novel type of local on-site spin excitations controlled by the Hund coupling.

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arXiv2018

Computing Resonant Inelastic X-Ray Scattering Spectra Using The Density Matrix Renormalization Group Method

We present a method for computing resonant inelastic x-ray scattering (RIXS) spectra in one-dimensional systems using the density matrix renormalization group (DMRG) method. By using DMRG to address the problem, we shift the computational bottleneck from the memory requirements associated with exact diagonalization (ED) calculations to the computational time associated with the DMRG algorithm. This approach is then used to obtain RIXS spectra on cluster sizes well beyond state-of-the-art ED techniques. Using this new procedure, we compute the low-energy magnetic excitations observed in Cu $L$-edge RIXS for the challenging corner shared CuO$_4$ chains, both for large multi-orbital clusters and downfolded $t$-$J$ chains. We are able to directly compare results obtained from both models defined in clusters with identical momentum resolution. In the strong coupling limit, we find that the downfolded $t$-$J$ model captures the features of the magnetic excitations probed by RIXS after a uniform scaling of the spectra is taken into account.

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arXiv2018

Doping evolution of charge and spin excitations in two-leg Hubbard ladders: comparing DMRG and RPA+FLEX results

We study the magnetic and charge dynamical response of a Hubbard model in a two-leg ladder geometry using the density matrix renormalization group (DMRG) method and the random phase approximation within the fluctuation-exchange approximation (RPA+FLEX). Our calculations reveal that RPA+FLEX can capture the main features of the magnetic response from weak up to intermediate Hubbard repulsion for doped ladders, when compared with the numerically exact DMRG results. However, while at weak Hubbard repulsion both the spin and charge spectra can be understood in terms of weakly-interacting electron-hole excitations across the Fermi surface, at intermediate coupling DMRG shows gapped spin excitations at large momentum transfer that remain gapless within the RPA+FLEX approximation. For the charge response, RPA+FLEX can only reproduce the main features of the DMRG spectra at weak coupling and high doping levels, while it shows an incoherent character away from this limit. Overall, our analysis shows that RPA+FLEX works surprisingly well for spin excitations at weak and intermediate Hubbard $U$ values even in the difficult low-dimensional geometry such as a two-leg ladder. Finally, we discuss the implications of our results for neutron scattering and resonant inelastic x-ray scattering experiments on two-leg ladder cuprate compounds.

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arXiv2017

Efficiency of fermionic quantum distillation

We present a time-dependent density-matrix renormalization group investigation of the quantum distillation process within the Fermi--Hubbard model on a quasi-1D ladder geometry. The term distillation refers to the dynamical, spatial separation of singlons and doublons in the sudden expansion of interacting particles in an optical lattice, i.e., the release of a cloud of atoms from a trapping potential. Remarkably, quantum distillation can lead to a contraction of the doublon cloud, resulting in an increased density of the doublons in the core region compared to the initial state. As a main result, we show that this phenomenon is not limited to chains that were previously studied. Interestingly, there are additional dynamical processes on the two-leg ladder such as density oscillations and selftrapping of defects that lead to a less efficient distillation process. An investigation of the time evolution starting from product states provides an explanation for this behaviour. Initial product states are also considered, since in optical lattice experiments such states are often used as the initial setup. We propose configurations that lead to a fast and efficient quantum distillation.

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arXiv2017

Possible Bicollinear Nematic State with Monoclinic Lattice Distortions in Iron Telluride Compounds

Iron telluride FeTe is known to display bicollinear magnetic order at low temperatures together with a monoclinic lattice distortion. Because the bicollinear order can involve two different wavevectors $(π/2,π/2)$ and $(π/2,-π/2)$, symmetry considerations allow for the possible stabilization of a nematic state with short-range bicollinear order coupled to monoclinic lattice distortions at a $T_S$ higher than the temperature $T_N$ where long-range bicollinear order fully develops. As a concrete example, the three-orbitals spin-fermion model for iron telluride is studied with an additional coupling $\tildeλ_{12}$ between the monoclinic lattice strain and an orbital-nematic order parameter with $B_{2g}$ symmetry. Monte Carlo simulations show that with increasing $\tildeλ_{12}$ the first-order transition characteristic of FeTe splits and bicollinear nematicity is stabilized in a (narrow) temperature range. In this new regime the lattice is monoclinically distorted and short-range spin and orbital order breaks rotational invariance. A discussion of possible realizations of this exotic state is provided.

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arXiv2017

Signatures of pairing in the magnetic excitation spectrum of strongly correlated ladders

Magnetic interactions are widely believed to play a crucial role in the microscopic mechanism leading to high critical temperature superconductivity. It is therefore important to study the signatures of pairing in the magnetic excitation spectrum of simple models known to show unconventional superconducting tendencies. Using the Density Matrix Renormalization Group technique, we calculate the dynamical spin structure factor $S({\bf k},ω)$ of a generalized $t-U-J$ Hubbard model away from half-filling in a two-leg ladder geometry. The addition of $J$ enhances pairing tendencies. We analyze quantitatively the signatures of pairing in the magnetic excitation spectra. We found that the superconducting pair-correlation strength, that can be estimated independently from ground state properties, is closely correlated with the integrated low-energy magnetic spectral weight in the vicinity of $(π,π)$. In this wave-vector region, robust spin incommensurate features develop with increasing doping. The branch of the spectrum with rung direction wave-vector $k_{rung}=0$ does not change substantially with doping where pairing dominates, and thus plays a minor role. We discuss the implications of our results for neutron scattering experiments, where the spin excitation dynamics of hole-doped quasi-one dimensional magnetic materials can be measured, and also address implications for recent resonant inelastic X-ray scattering experiments.

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arXiv2017

Pairing Tendencies in a Two-orbital Hubbard Model in One Dimension

The recent discovery of superconductivity under high pressure in the ladder compound BaFe$_2$S$_3$ has opened a new field of research in iron-based superconductors with focus on quasi one-dimensional geometries. In this publication, using the Density Matrix Renormalization Group technique, we study a two-orbital Hubbard model defined in one dimensional chains. Our main result is the presence of hole binding tendencies at intermediate Hubbard $U$ repulsion and robust Hund coupling $J_H/U=0.25$. Binding does not occur neither in weak coupling nor at very strong coupling. The pair-pair correlations that are dominant near half-filling, or of similar strength as the charge and spin correlation channels, involve hole-pair operators that are spin singlets, use nearest-neighbor sites, and employ different orbitals for each hole. The Hund coupling strength, presence of robust magnetic moments, and antiferromagnetic correlations among them are important for the binding tendencies found here.

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