SearcharxivSearch

arXiv subjects

Armando Consiglio

Publications and source records attributed to Armando Consiglio.

At least 19 recordsLinked to original sources

Competing lattice structures induced by Sn substitution in CsV$_3$Sb$_5$

Understanding the effect of chemical substitution on competing phases of kagome metals is crucial for disentangling the interplay between local structural distortions and electronic instabilities. In \cvs, Sn substitution strongly modifies the electronic phase diagram, yet the microscopic mechanism driving this remains unclear. Here, we combine $^{121}$Sb nuclear quadrupole resonance (NQR) measurements and density functional theory calculations to investigate the atomic-scale effects of Sn substitution in CsV$_3$Sb$_{5-x}$Sn$_x$. At low Sn concentrations, the observed satellite NQR peaks exhibit signatures of local structural distortion induced by Sn substitution, qualitatively consistent with our computational analysis. These impurity-induced features persist across the entire experimentally investigated doping range, up to $x$ = 0.65, and remain observable up to room temperature. For $x=1$, the fully doped idealized case, the estimated dynamical instabilities of the kagome lattice suggest the stabilization of two nearly energy-degenerate equilibrium structures characterized by V-trimers, distinguished by a zero- or $\pi$-phase shift between adjacent layers along the $c$-axis. Together, these results show that Sn substitution drives a complex interplay between local impurity-induced distortions and competing structural instabilities in vanadium-based kagome compounds.

cond-mat.str-el

Chiral Phonons Coupled to Spin-Split Bands in Altermagnetic CrSb and MnTe

Altermagnets exhibit momentum-dependent spin splitting without net magnetization, providing a unique platform where magnetic order, electronic structure and lattice dynamics intertwine. Here, using first-principles calculations, we demonstrate that the prototypical altermagnets CrSb and MnTe host locally chiral phonon modes carrying finite phonon angular momentum with a six-lobes $f$-wave texture in momentum space. Our results show that the chiral lattice motion originates from the pnictogen/chalcogen sublattice, while the altermagnetic spin splitting is generated by the magnetic transition-metal atoms, indicating that chiral lattice dynamics and altermagnetic electronic states originate from different atomic sublattices of the same crystal. In pristine compounds, at each valley, inversion symmetry suppresses the net phonon angular momentum despite local circular atomic motion. We further demonstrate that isoelectronic symmetry lowering induced by chemical substitution lifts this cancellation and generates finite valley phonon chirality, while keeping the altermagnetic nature of the compounds intact. Most importantly, we reveal that chiral phonons couple to momentum-dependent spin-split electronic bands through momentum-dependent electron-phonon interaction, producing characteristic modifications of the electronic structure, possibly accessible by photoemission experiments. Our results establish altermagnets as a promising platform for chiral phononics and spin-selective lattice control.

cond-mat.mtrl-sci

Continuum theory for topological phase transitions in exciton systems

An effective continuum theory is constructed for the topological phase transition of excitons in quasi-two-dimensional systems. These topological excitons crucially determine the optoelectronic properties, because of their larger binding energies in 2D as well as their topologically enhanced exciton transport. The core idea of this letter is, that the essential physics determining the topological invariants across the phase transition is localized near $N$-fold band-crossing points (BCPs) in the interaction-induced exciton band structure. The construction of the continuum theory around these BCPs needs only the information of exciton states that build up these BCPs at both $\mathbf{Q}=0$ and finite $\mathbf{Q}$ points, and not the numerically challenging solution of the Bethe-Salpeter equation over the full exciton Brillouin zone. This theory applies to systems with and without spin conservation. Our theory is illustrated in two specific examples: the transition metal dichalcogenide twisted bilayer systems and the Bernevig-Hughes-Zhang (BHZ) model. These results offer a promising route toward studying complex systems, such as the room-temperature quantum spin Hall system Bismuthene (Bi/SiC) and other twisted bilayer systems.

cond-mat.str-el

Tuning electronic correlations in the Kagome metals $RT_3$B$_2$

The $RT_3$B$_2$ ($R=$Y, Lu, $T=$ Co, Os) family hosts a perfect kagome lattice of $T$ atoms, offering an interesting platform to investigate the interplay of electronic structure, superconductivity, and lattice dynamics. Here, we compare two members of this family, LuOs$_3$B$_2$ and YCo$_3$B$_2$, with similar crystallography but differing chemical composition, leading to distinct electronic correlation strengths and spin-orbit coupling effects. We confirm superconductivity in LuOs$_3$B$_2$ with $T_c = 4.75$K, while YCo$_3$B$_2$ remains non-superconducting above 1.8K. First-principles estimates of the electron-phonon coupling for LuOs$_3$B$_2$ are consistent with its observed $T_c$ and suggest a moderate coupling strength. Both materials exhibit kagome-derived electronic features, including quasi-flat bands, Dirac cones, and van Hove singularities. Fermi surface calculations reveal quasi-one-dimensional behavior along the $c$-axis in YCo$_3$B$_2$, in contrast to the more three-dimensional Fermiology of LuOs$_3$B$_2$. Phonon calculations for LuOs$_3$B$_2$ show imaginary modes, indicating potential lattice instabilities. Experimental estimates of the Wilson and Kadowaki-Woods ratios point to non-negligible electronic correlations in both compounds.

cond-mat.str-el

Moir\'e-resonant surface state in ultrathin RuO$_2$

RuO$_2$ has emerged as a prototypical candidate for altermagnetism. In the face of daunting evidence for magnetic order in the bulk, the focus naturally shifted to surfaces and ultrathin films, where Coulomb interactions are dimensionally quenched and electron correlations strongly enhanced. Here, we examine atomically ordered, ultrathin RuO$_2$(110) grown on Ru(0001) using a combination of scanning tunneling microscopy (STM), density functional theory, and density matrix renormalization group methods. We observe a nonmagnetic charge order that is imprinted by the incommensurate moir\'e stacking with the substrate and enhanced by the electronic Fermi surface scattering within the flat-band surface state. We further identify a nonmagnetic, metastable $c(2 \times 2)$ surface reconstruction that arises from surface phonon softening and can be toggled reversibly via STM tip manipulation. Spin-polarized STM measurements, however, reveal no evidence of magnetic order on the RuO$_2$(110) surface. Our findings of a nonmagnetic charge-modulation position ultrathin RuO$_2$(110) as an intriguing platform for exploring moir\'e-assisted electronic orders.

cond-mat.mtrl-sci

Theory of excitonic order in kagome metals ScV$_6$Sn$_6$ and LuNb$_6$Sn$_6$

We argue that kagome metals can feature an excitonic condensate of unconventional nature. Studying the recently discovered variants ScV$_6$Sn$_6$ and LuNb$_6$Sn$_6$ we identify electron and hole pockets due to a pair of van Hove singularities (vHS) close to the Fermi level, with an approximate spectral particle-hole symmetry. A significant fraction of the Fermi level density of states away from the vHS is removed by the onset of high temperature charge density wave order, and makes the bands more two-dimensional, setting the stage for the formation of excitons. We develop a two-orbital minimal tight-binding model of these materials which captures these features along with the sublattice support of the wavefunctions, and find $s$- or $d$-wave excitons depending on interaction parameters -- the latter of which exhibits either charge nematicity or time-reversal symmetry breaking (TRSB) depending on strain, offering an explanation of recent STM and transport experiments. The presence of particle- and hole-type vHS, and the associated excitonic resonance, may be a common thread to understanding nematicity and TRSB in kagome metals.

cond-mat.str-el

Anomalous spin-optical helical effect in Ti-based kagome metal

The kagome lattice stands as a rich platform for hosting a wide array of correlated quantum phenomena, ranging from charge density waves and superconductivity to electron nematicity and loop current states. Direct detection of loop currents in kagome systems has remained a formidable challenge due to their intricate spatial arrangements and the weak magnetic field signatures they produce. This has left their existence and underlying mechanisms a topic of intense debate. In this work, we uncover a hallmark reconcilable with loop currents: spin handedness-selective signals that surpass conventional dichroic, spin, and spin-dichroic responses. We observe this phenomenon in the kagome metal CsTi$_3$Bi$_5$ and we call it the anomalous spin-optical helical effect. This effect arises from the coupling of light' s helicity with spin-orbital electron correlations, providing a groundbreaking method to visualize loop currents in quantum materials. Our discovery not only enriches the debate surrounding loop currents but also paves the way for new strategies to exploit the electronic phases of quantum materials via light-matter interaction.

cond-mat.str-el

Uniaxial strain tuning of charge modulation and singularity in a kagome superconductor

Tunable quantum materials hold great potential for applications. Of special interest are materials in which small lattice strain induces giant electronic responses. The kagome compounds AV3Sb5 (A = K, Rb, Cs) provide a testbed for such singular electronic states. In this study, through angle-resolved photoemission spectroscopy, we provide comprehensive spectroscopic measurements of the giant responses induced by compressive and tensile strains on the charge-density-wave (CDW) order parameter and high-order van Hove singularity (HO-VHS) in CsV3Sb5. We observe a tripling of the CDW gap magnitudes with ~1% strain, accompanied by the changes of both energy and mass of the saddle-point fermions. Our results reveal an anticorrelation between the unconventional CDW order parameter and the mass of a HO-VHS, and highlight the role of the latter in the superconducting pairing. The giant electronic responses uncover a rich strain tunability of the versatile kagome system in studying quantum interplays under lattice perturbations.

cond-mat.mtrl-sci

Theory of unconventional magnetism in a Cu-based kagome metal

Kagome metals have established a new arena for correlated electron physics. To date, the predominant experimental evidence centers around unconventional charge order, nematicity, and superconductivity, while magnetic fluctuations due to electronic interactions, i.e., beyond local atomic magnetism, have largely been elusive. We find the challenge of locating the appropriate parameter regime for such exotic order to center around two aspects. First, the correlations implied by low-energy orbitals have to be sufficiently large to yield a dominance of magnetic fluctuations and weak to retain an itinerant parent state. Second, the kinematic kagome profile at the Fermi level demands an efficient mitigation of sublattice interference causing the suppression of magnetic fluctuations descending from electronic on-site repulsion. We elucidate our methodology by analyzing the potential copper-based kagome compound CsCu$_3$Cl$_5$: From ab initio design and many-body analysis, we develop a model framework of realistic Cu-based kagome materials the simulations of which reveal unconventional magnetic order in a kagome metal.

cond-mat.str-el

Pomeranchuk instability from electronic correlations in CsTi$_3$Bi$_5$ kagome metal

Among many-body instabilities in correlated quantum systems, electronic nematicity, defined by the spontaneous breaking of rotational symmetry, has emerged as a critical phenomenon, particularly within high-temperature superconductors. Recently, this behavior has been identified in CsTi$_3$Bi$_5$, a member of the AV$_3$Sb$_5$ (A = K, Rb, Cs) kagome family, recognized for its intricate and unconventional quantum phases. Despite accumulating indirect evidence, the fundamental mechanisms driving nematicity in CsTi$_3$Bi$_5$ remain inadequately understood, sparking ongoing debates. In this study, we employ polarization-dependent angle-resolved photoemission spectroscopy to reveal definitive signatures of an orbital-selective nematic deformation in the electronic structure of CsTi$_3$Bi$_5$. This direct experimental evidence underscores the pivotal role of orbital degrees of freedom in symmetry breaking, providing new insights into the complex electronic environment. By applying the functional renormalization group technique to a fully interacting ab initio model, we demonstrate the emergence of a finite angular momentum ($d$-wave) Pomeranchuk instability in CsTi$_3$Bi$_5$, driven by the concomitant action of electronic correlations within specific orbital channels and chemical potential detuning away from Van Hove singularities. By elucidating the connection between orbital correlations and symmetry-breaking instabilities, this work lays a crucial foundation for future investigations into the broader role of orbital selectivity in quantum materials, with far-reaching implications for the design and manipulation of novel electronic phases.

cond-mat.str-el

Pomeranchuk Instability Induced by an Emergent Higher-Order van Hove Singularity on the Distorted Kagome Surface of Co$_3$Sn$_2$S$_2$

Materials hosting flat bands at the vicinity of the Fermi level promote exotic symmetry broken states. Common to many of these are van Hove singularities at saddle points of the dispersion or even higher-order van Hove singularities where the dispersion is flattened further. The band structure of kagome metals hosts both a flat band and two regular saddle points flanking a Dirac node. We investigate the kagome ferromagnetic metal Co$_3$Sn$_2$S$_2$ using scanning tunneling spectroscopy. We identify a new mechanism by which a triangular distortion on its kagome Co$_3$Sn surface termination considerably flattens the saddle point dispersion, and induces an isolated higher-order van Hove singularity (HOvHS) with algebraically divergent density of states pinned to the Fermi energy. The distortion-induced HOvHS precipitates a Pomeranchuk instability of the Fermi surface, resulting in the formation of a series of nematic electronic states. We visualize the nematic order across an energy shell of about 100 meV in both real-, reciprocal-, and momentum-spaces, as a cascade of wavefunction distributions which spontaneously break the remaining rotational symmetry of the underlying distorted kagome lattice, without generating any additional translational symmetry breaking. It signifies the spontaneous removal of a subset of saddle points from the Fermi energy to lower energies. By tracking the electronic wavefunction structure across the deformed Fermi surface we further identify a charge pumping-like evolution of the wavefunction center of mass. The mechanism we find for the generation of higher-order saddle points under a kagome distortion may be common to other kagome materials, and potentially other lattice structures, suggesting a generic new avenue for inducing unconventional electronic instabilities towards exotic states of matter.

cond-mat.str-el

Orbital-selective spin-triplet superconductivity in infinite-layer LaNiO$_2$

The discovery of superconductivity in infinite-layer nickelates has ignited stark interest within the scientific community, particularly regarding its likely unconventional origin. Conflicting magnetotransport measurements report either isotropic or anisotropic suppression of superconductivity in an external magnetic field, with distinct implications for the nature of superconducting order. In order to ensure a most suited model subject to subsequent many-body analysis, we develop a first-principles-guided minimal theory including Ni $d_{x^2-y^2}$, La $d_{3z^2-r^2}$, and La $d_{xy}$ orbitals. Amended by the consideration of orbital-selective pairing formation, which emphasises the correlation state of the Ni $3d_{x^2-y^2}$ orbital, we calculate the superconducting ordering susceptibility mediated by spin fluctuations. We find a parametric competition between even-parity $d$-wave and, in contrast to previous studies, odd-parity $p$-wave pairing, which becomes favorable through a large quasiparticle weight renormalization for Ni $3d_{x^2-y^2}$ electrons. Our findings not only shed light on the distinctiveness of LaNiO$_2$ as compared to cuprate superconductors or nickelates of different rare-earth composition but also suggest similarities to other candidate odd-parity superconductors.

cond-mat.supr-con

Strain-induced enhancement of the charge-density-wave in the kagome metal ScV$_6$Sn$_6$

The kagome geometry is an example of frustrated configuration in which rich physics takes place, including the emergence of superconductivity and charge density wave (CDW). Among the kagome metals, ScV$_6$Sn$_6$ hosts an unconventional CDW, with its electronic order showing a different periodicity than that of the phonon which generates it. In this material, a CDW-softened flat phonon band has a second-order collapse at the same time that the first order transition occurs. This phonon band originates from the out-of-plane vibrations of the Sc and Sn atoms, and it is at the base of the electron-phonon-coupling driven CDW phase of ScV$_6$Sn$_6$. Here, we use uniaxial strain to tune the frequency of the flat phonon band, tracking the strain evolution via time-resolved optical spectroscopy and first-principles calculations. Our findings emphasize the capability to induce an enhancement of the unconventional CDW properties in ScV$_6$Sn$_6$ kagome metal through control of strain.

cond-mat.str-el

Flat band separation and robust spin-Berry curvature in bilayer kagome metals

Kagome materials have emerged as a setting for emergent electronic phenomena that encompass different aspects of symmetry and topology. It is debated whether the XV$_6$Sn$_6$ kagome family (where X is a rare earth element), a recently discovered family of bilayer kagome metals, hosts a topologically non-trivial ground state resulting from the opening of spin-orbit coupling gaps. These states would carry a finite spin-Berry curvature, and topological surface states. Here, we investigate the spin and electronic structure of the XV$_6$Sn$_6$ kagome family. We obtain evidence for a finite spin-Berry curvature contribution at the center of the Brillouin zone, where the nearly flat band detaches from the dispersing Dirac band because of spin-orbit coupling. In addition, the spin-Berry curvature is further investigated in the charge density wave regime of ScV$_6$Sn$_6$, and it is found to be robust against the onset of the temperature-driven ordered phase. Utilizing the sensitivity of angle resolved photoemission spectroscopy to the spin and orbital angular momentum, our work unveils the spin-Berry curvature of topological kagome metals, and helps to define its spectroscopic fingerprint.

cond-mat.str-el

Theory of nematic charge orders in kagome metals

Kagome metals $A$V$_3$Sb$_5$ ($A=$K, Rb, Cs) exhibit an exotic charge order (CO), involving three order parameters, with broken translation and time-reversal symmetries compatible with the presence of orbital currents. The properties of this phase are still intensely debated, and it is unclear if the origin of the CO is mainly due to electron-electron or electron-phonon interactions. Most of the experimental studies confirm the nematicity of this state, a feature that might be enhanced by electronic correlations. However, it is still unclear whether the nematic CO becomes stable at a temperature equal to ($T_{\text{nem}} = T_\text{C}$) or lower than ($T_{\text{nem}} < T_\text{C}$) the one of the CO itself. Here, we systematically characterize several CO configurations, some proposed for the new member of the family ScV$_6$Sn$_6$, by combining phenomenological Ginzburg-Landau theories, valid irrespective of the specific ordering mechanism, with mean-field analysis. We find a few configurations for the CO that are in agreement with most of the experimental findings to date and that are described by different Ginzburg-Landau potentials. We propose to use resonant ultrasound spectroscopy to experimentally characterize the order parameters of the CO, such as the number of their components and their relative amplitude, and provide an analysis of the corresponding elastic tensors. This might help understand which mean-field configuration found in our study is the most representative for describing the CO state of kagome metals, and it can provide information regarding the nematicity onset temperature $T_\text{nem}$ with respect to $T_\text{C}$.

cond-mat.str-el

Observation of room temperature excitons in an atomically thin topological insulator

Optical spectroscopy of ultimately thin materials has significantly enhanced our understanding of collective excitations in low-dimensional semiconductors. This is particularly reflected by the rich physics of excitons in atomically thin crystals which uniquely arises from the interplay of strong Coulomb correlation, spin-orbit coupling (SOC), and lattice geometry. Here we extend the field by reporting the observation of room temperature excitons in a material of non-trivial global topology. We study the fundamental optical excitation spectrum of a single layer of bismuth atoms epitaxially grown on a SiC substrate (hereafter bismuthene or Bi/SiC) which has been established as a large-gap, two-dimensional (2D) quantum spin Hall (QSH) insulator. Strongly developed optical resonances are observed to emerge around the direct gap at the K and K' points of the Brillouin zone, indicating the formation of bound excitons with considerable oscillator strength. These experimental findings are corroborated, concerning both the character of the excitonic resonances as well as their energy scale, by ab-initio \emph{GW} and Bethe-Salpeter equation calculations, confirming strong Coulomb interaction effects in these optical excitations. Our observations provide the first evidence of excitons in a 2D QSH insulator at room temperature, with excitonic and topological physics deriving from the very same electronic structure.

cond-mat.mtrl-sci

Nature of unconventional pairing in the kagome superconductors AV$_3$Sb$_5$

The recent discovery of AV$_3$Sb$_5$ (A=K,Rb,Cs) has uncovered an intriguing arena for exotic Fermi surface instabilities in a kagome metal. Among them, superconductivity is found in the vicinity of multiple van Hove singularities, exhibiting indications of unconventional pairing. We show that the sublattice interference mechanism is central to understanding the formation of superconductivity in a kagome metal. Starting from an appropriately chosen minimal tight-binding model with multiple with multiple van Hove singularities close to the Fermi level for AV$_3$Sb$_5$, we provide a random phase approximation analysis of superconducting instabilities. Non-local Coulomb repulsion, the sublattice profile of the van Hove bands, and the bare interaction strength turn out to be the crucial parameters to determine the preferred pairing symmetry. Implications for potentially topological surface states are discussed, along with a proposal for additional measurements to pin down the nature of superconductivity in AV$_3$Sb$_5$.

cond-mat.supr-con

Dynamics and Resilience of the Charge Density Wave in a bilayer kagome metal

Long-range electronic order descending from a metallic parent state constitutes a rich playground to study the intricate interplay of structural and electronic degrees of freedom. With dispersive and correlation features as multifold as topological Dirac-like itinerant states, van-Hove singularities, correlated flat bands, and magnetic transitions at low temperature, kagome metals are located in the most interesting regime where both phonon and electronically mediated couplings are significant. Several of these systems undergo a charge density wave (CDW) transition, and the van-Hove singularities, which are intrinsic to the kagome tiling, have been conjectured to play a key role in mediating such an instability. However, to date, the origin and the main driving force behind this charge order is elusive. Here, we use the topological bilayer kagome metal ScV6Sn6 as a platform to investigate this puzzling problem, since it features both kagome-derived nested Fermi surface and van-Hove singularities near the Fermi level, and a CDW phase that affects the susceptibility, the neutron scattering, and the specific heat, similarly to the siblings AV3Sb5 (A = K, Rb, Cs) and FeGe. We report on our findings from high-resolution angle-resolved photoemission, density functional theory, and time-resolved optical spectroscopy to unveil the dynamics of its CDW phase. We identify the structural degrees of freedom to play a fundamental role in the stabilization of charge order. Along with a comprehensive analysis of the subdominant impact from electronic correlations, we find ScV6Sn6 to feature an instance of charge density wave order that predominantly originates from phonons. As we shed light on the emergent phonon profile in the low-temperature ordered regime, our findings pave the way for a deeper understanding of ordering phenomena in all CDW kagome metals.

cond-mat.str-el