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N. S. Vidhyadhiraja

Publications and source records attributed to N. S. Vidhyadhiraja.

At least 19 recordsLinked to original sources

Quantitative DFT+DMFT description of spectra and transport in the moderately correlated metal SrVO$_3$

A quantitative, material-specific account of spectral and transport properties remains a central challenge in the theory of strongly correlated materials. Combining density functional theory with dynamical mean-field theory (DFT+DMFT) has proven to be a powerful approach for treating electron correlation effects and material specificity on an equal footing. Here, we examine the single-particle spectra and the dc and optical conductivity of SrVO$_3$, a prototypical, moderately correlated metal, within this framework. The degenerate $t_{2g}$ active space of SrVO$_3$, together with its well-established Fermi-liquid behavior, admits an effective-mass description governed by a single quasiparticle weight, yielding a nearly universal picture of the low-frequency, low-temperature regime. Employing a computationally efficient, real-frequency multi-orbital iterative perturbation theory (MO-IPT) impurity solver, we find reasonable agreement with experimental measurements of dc resistivity and optical conductivity across the entire experimentally relevant $(ω, T)$ range within a single, unified scheme. The agreement is shown to not depend on specific interaction parameters provided the quasiparticle weight is kept constant. These results indicate that, in SrVO$_3$, the $\mathbf{k}$-dependence of the self-energy may be weak, and vertex corrections may not dominate the dc and optical transport in this material.

cond-mat.str-el↗

Vortex Transport in Ni/Bi Bilayer Superconductor with Strong Spin-Orbit and Exchange Interaction

Nickel/bismuth (Ni/Bi) bilayers are a promising platform for exploring unconventional superconductivity. Ferromagnetic Ni is coupled to Bi, a strong spin orbit metal that only becomes superconducting below approx 10 mK, forming a bilayer exhibits superconductivity at a much higher temperatures, a Tc of 3 to 4 K. Such a bilayer thus makes an ideal system to probe Cooper pairing in strong spin orbit coupled magnetic environments. Magneto transport studies near Tc reveal the behavior of vortex dynamics and exchange proximity effects. It is seen that isolated vortices of the bilayers respond sensitively to out of plane fields, producing antisymmetric transverse resistance peaks attributable to competing Magnus and viscous forces. Control experiments using a ferromagnetic insulator confirm that superconductivity extends throughout the bilayer, not just confined at the interface. Overall, the results provide a unified picture of transport dominated by vortex dynamics and show that a conventional s wave order parameter accounts for the observations, with any likely unconventional contributions being only subtle.

cond-mat.supr-con↗

A typical medium cluster approach for multi-branch phonon localization

The phenomenon of Anderson localization in various disordered media has sustained significant interest over many decades. Specifically, the Anderson localization of phonons has been viewed as a potential mechanism for creating fascinating thermal transport properties in materials. However, despite extensive work, the influence of the vector nature of phonons on the Anderson localization transition has not been well explored. In order to achieve such an understanding, we extend a recently developed phonon dynamical cluster approximation (DCA) and its typical medium variant (TMDCA) to investigate spectra and localization of multi-branch phonons in the presence of pure mass disorder. We validate the new formalism against several limiting cases and exact diagonalization results. A comparison of results for the single-branch versus multi-branch case shows that the vector nature of the phonons does not affect the Anderson transition of phonons significantly. The developed multi-branch TMDCA formalism can be employed for studying phonon localization in real materials.

cond-mat.dis-nn↗

Universal Mott quantum criticality in a modified periodic Anderson model

Mott quantum criticality is a central theme in correlated electron physics, observed in systems featuring both continuous zero-temperature transitions and those with finite-temperature critical endpoints. Within dynamical mean-field theory (DMFT), the paradigmatic single-band Hubbard model (SBHM) displays such criticality only above a finite-temperature endpoint. In contrast, the modified periodic Anderson model (MPAM) is a rare example known to host a surface of genuinely continuous Mott quantum critical points (QCPs) at zero temperature. Using DMFT with the numerical renormalization group as an impurity solver, we investigate the finite-temperature, real-frequency properties of the MPAM. Our central finding is the emergence of quantum critical scaling in the electrical resistivity, with critical exponents $z_{\text{met}} = 0.76$ and $z_{\text{ins}} = 0.66$ on the metallic and insulating sides, respectively. These values fall within the range reported for the SBHM, suggesting that both transitions are governed by a common universality class. We further substantiate the presence of local quantum criticality by demonstrating robust $ω/T$ scaling in single- and two-particle correlation functions. Finally, we identify novel transport signatures in the optical conductivity, where the distinct evolution of two isosbestic points serves as a unique fingerprint of the QCP. These results establish the MPAM as a canonical model for investigating genuine Mott quantum criticality and support the existence of a universal framework for this fundamental phenomenon.

cond-mat.str-el↗

Interplay of strong correlations and covalency in ionic band insulators

We address the role of electronic correlations in different kinds of band insulators by using the two-orbital Hubbard model within the dynamical mean-field theory (DMFT). An intriguing finding is that electronic correlations turn a metal into a band insulator when ionicity and covalency are equal in ratio.We conclude that the electronic correlations favour metallicity when the covalency is smaller than the ionicity, while they favour insulating behaviour when the covalency is greater than ionicity.

cond-mat.str-el↗

Mott Criticality as the Confinement Transition of a Pseudogap-Mott Metal

The phenomenon of Mott insulation involves the localization of itinerant electrons due to strong local repulsion. Upon doping, a pseudogap (PG) phase emerges - marked by selective gapping of the Fermi surface without conventional symmetry breaking in spin or charge channels. A key challenge is understanding how quasiparticle breakdown in the Fermi liquid gives rise to this enigmatic state, and how it connects to both the Mott insulating and superconducting phases. Here, we develop a renormalization-based construction of strongly correlated lattice models that captures the emergence of the pseudogap phase and its transition to a Mott insulator. Applying a many-body tiling scheme to the fixed-point impurity model uncovers a lattice model with electron interactions and Kondo physics. At half-filling, the interplay between Kondo screening and bath charge fluctuations in the impurity model leads to Fermi liquid breakdown. This reveals a pseudogap phase characterized by a non-Fermi liquid (the Mott metal) residing on nodal arcs, gapped antinodal regions of the Fermi surface, and an anomalous scaling of the electronic scattering rate with frequency. The eventual confinement of holon-doublon excitations of this exotic metal obtains a continuous transition into the Mott insulator. Our results identify the pseudogap as a distinct long-range entangled quantum phase, and offer a new route to Mott criticality beyond the paradigm of local quantum criticality.

cond-mat.str-el↗

Anderson Impurities In Edge States with Nonlinear and Dissipative Perturbations

We show that exceptional points (EPs) and non-Hermitian behavior can emerge dynamically in impurity models with Hermitian microscopic origins. Using perturbative renormalization group (RG) analysis, Fock-space diagonalization, and spin-spin relaxation time calculations, we demonstrate that nonlinear (NL) dispersion and anisotropic pseudochiral (PC) interactions generate complex fixed points and spectral defectiveness. The effective Kondo model features a square-root RG invariant linking planar and longitudinal Dzyaloshinskii--Moriya (DM) couplings, driving the onset of EPs. Our analysis reveals dissipative fixed points stabilized by an emergent Lie algebra structure and a scaling collapse in relaxation dynamics. Across both single- and two-impurity extensions, we identify a universal ``sign-reversion'' (SR) regime near critical NL coupling, where anisotropy preserves PC symmetry and SR serves as a signature of non-Hermitian flow. These results establish a new class of non-Hermitian criticality generated through RG evolution in otherwise Hermitian systems.

cond-mat.str-el↗

Intricately Entangled Spin and Charge Diffusion and the Coherence-Incoherence Crossover in the High-Dimensional Hubbard Model

Correlation-driven metal-insulator transitions and temperature-driven quantum-coherent-to-incoherent crossovers in correlated electron systems underpin the doping, temperature and frequency-resolved evolution of physical responses. Motivated by recent experimental studies that investigate the evolution of dynamical spin and charge responses, we analyze the spin and charge diffusion spectra in both half-filled and doped one-band Hubbard model using Dynamical Mean Field Theory (DMFT) combined with the Numerical Renormalization Group (NRG). We compare the relative strengths and limitations of Density Matrix NRG (DMNRG) and Full Density Matrix NRG (FDM-NRG) in capturing low-frequency spectral features and their evolution with temperature, interaction strength and band-filling. Key measures, including characteristic frequency scales, Kullback-Leibler divergence, diffusion constants, and kurtosis provide complementary but internally consistent picture for the evolution of spin and charge excitations across bandwidth as well as the band-filling driven Mott transitions and the coherent-incoherent crossover. We find that spin and charge fluctuations cross over from quantum-coherent-to-quantum-incoherent at distinct temperatures, providing a microscopic insight into the complex, two-stage, Fermi-to-non-Fermi liquid-to-bad metal crossovers seen in transport data, in particular in the $dc$ resistivity.

cond-mat.str-el↗

Emergent soft-gap Anderson models at quantum criticality in a lattice Hamiltonian within dynamical mean field theory

Local quantum criticality in itinerant fermion systems has been extensively investigated through the soft-gap Anderson impurity model, wherein a localized, correlated impurity, hybridizes with a broad conduction band with a singular, $|ω|^r$, density of states. However, lattice models hosting quantum critical points (QCPs), do not appear to have such a spectrum emerging at the QCP. In this work, we report the emergence of such a singular form of the density of states in a three-orbital lattice model, within dynamical mean field theory, precisely at a quantum critical point, separating a gapless, Fermi liquid, metallic phase from a gapped, Mott insulating phase. A temperature-dependent exponent, $α$, defined using the corresponding Matsubara self-energy, is found to vary from $+1$ deep in the FL regime, to $-1$ in the Mott insulator regime. Interestingly, we find that $α$ becomes temperature independent, and hence isosbestic, precisely at the QCP. The isosbestic exponent is shown to lead to an emergent soft-gap spectrum, $|ω|^r$ at the QCP, where $r = |α_{\rm iso}|$. We discuss the implications of our findings for non-Fermi liquid behaviour in the quantum critical region of the phase diagram.

cond-mat.str-el↗

Tomonaga-Luttinger liquid and quantum criticality in spin-1/2 antiferromagnetic Heisenberg chain C14H18CuN4O10 via Wilson ratio

The ground state of a one-dimensional spin-1/2 uniform antiferromagnetic Heisenberg chain (AfHc) is a Tomonaga-Luttinger liquid which is quantum-critical with respect to applied magnetic fields upto a saturation field Hs beyond which it transforms to a fully polarised state. Wilson ratio has been predicted to be a good indicator for demarcating these phases [Phys. Rev. B 96, 220401 (2017)]. From detailed temperature and magnetic field dependent magnetisation, magnetic susceptibility and specific heat measurements in a metalorganic complex and comparisons with field theory and quantum transfer matrix method calculations, the complex was found to be a very good realisation of a spin-1/2 AfHc. Wilson ratio obtained from experimentally obtained magnetic susceptibility and magnetic contribution of specific heat values was used to map the magnetic phase diagram of the uniform spin-1/2 AfHc over large regions of phase space demarcating Tomonaga-Luttinger liquid, saturation field quantum critical, and fully polarised states. Luttinger parameter and spinon velocity were found to match very well with the values predicted from conformal field theory.

cond-mat.str-el↗

Strong Local Bosonic Fluctuation: The Key to Understanding Strongly Correlated Metals

In this paper, we present a theoretical framework for understanding the Extremely Correlated Fermi Liquid (ECFL) phenomenon within the $U=\infty$ Hubbard model. Our approach involves deriving equations of motion for the single-particle Green's function $G$ and its associated self-energy $Σ$, which involves the product of the bosonic correlation function comprising both density ($D_N$) and spin ($D_S$) correlations with $G$. By solving these equations self-consistently, we explore the behavior of $G$, $D_N$, and $D_S$ as functions of frequency, temperature, and hole concentration. Our results reveal distinct coherent and incoherent Fermi liquid regimes characterized by the presence or absence of quasiparticle excitations. Additionally, we analyze the intrinsic dc resistivity $ρ(T)$, observing a crossover from $T^2$ to linear behavior with increasing temperature. Our findings delineate Fermi liquid, quantum incoherent, and `classical' regimes in strongly correlated systems, emphasizing the importance of quantum diffusive local charge and spin fluctuations.

cond-mat.str-el↗

Steady-state dc transport through an Anderson impurity coupled to leads with spin-orbit coupling

We study the steady-state dc transport characteristics of a system comprised of an interacting quantum dot, modelled as an Anderson impurity, coupled to two metallic non-interacting leads with Rashba SOC, using an interpolative perturbative approach (IPA). The single-particle spectra, current and differential conductance are obtained in weak and strong coupling regimes over a wide range of SOC and bias values. Extensive benchmarking of the IPA validates the method in the linear as well as non-linear response regime. The universal, zero bias ($V_{sd}=0$) peak with a width proportional to the Kondo scale ($T_K$) and two non-universal finite bias peaks around $V_{sd}=\pm U$ in the zero temperature differential conductance show a clear separation with increasing $U$ or increasing SOC. In the strong coupling regime, increasing temperature induces melting of the zero bias peak leading to a crossover from a three-peak conductance to a two-peak conductance. Recent experiments find the emergence of a two-peak structure by increasing SOC at a fixed temperature. Our results appear to provide a qualitative explanation of these observations as a SOC tuned crossover from weak/intermediate to strong coupling, and a simultaneous crossover from low $T/T_K$ to high $T/T_K$ ratio. We also reproduce the experimentally observed temperature dependence of the zero bias conductance.

cond-mat.mes-hall↗

Kondo frustration via charge fluctuations: a route to Mott localisation

We propose a minimal effective impurity model that captures the phenomenology of the Mott-Hubbard metal-insulator transition (MIT) of the half-filled Hubbard model on the Bethe lattice in infinite dimensions as observed by dynamical mean field theory (DMFT). This involves extending the standard Anderson impurity model Hamiltonian to include an explicit Kondo coupling $J$, as well as a local on-site correlation $U_b$ on the conduction bath site connected directly to the impurity. For the case of attractive local bath correlations ($U_{b}<0$), the extended Anderson impurity model (e-SIAM) sheds new light on several aspects of the DMFT phase diagram. For example, the $T=0$ metal-to-insulator quantum phase transition (QPT) is preceded by an excited state quantum phase transition (ESQPT) where the local moment eigenstates are emergent in the low-lying spectrum. Long-ranged fluctuations are observed near both the QPT and ESQPT, suggesting that they are the origin of the quantum critical scaling observed recently at high temperatures in DMFT simulations. The $T=0$ gapless excitations at the QCP display particle-hole interconversion processes, and exhibit power-law behaviour in self-energies and two-particle correlations. These are signatures of non-Fermi liquid behaviour that emerge from the partial breakdown of the Kondo screening.

cond-mat.str-el↗

Frustration shapes multi-channel Kondo physics: a star graph perspective

We study the overscreened multi-channel Kondo (MCK) model using the recently developed unitary renormalization group (URG) technique. Our results display the importance of ground state degeneracy in explaining various important properties like the breakdown of screening and the presence of local non-Fermi liquids. The impurity susceptibility of the intermediate coupling fixed point Hamiltonian in the zero-bandwidth (or star graph) limit shows a power-law divergence at low temperature, signalling its critical nature. Despite the absence of inter-channel coupling in the MCK fixed point Hamiltonian, the study of mutual information between any two channels shows non-zero correlation between them. A spectral flow analysis of the star graph reveals that the degenerate ground state manifold possesses topological quantum numbers. The low energy effective Hamiltonian obtained upon adding a finite non-zero conduction bath dispersion to the star graph Hamiltonian for both the two and three-channel cases displays the presence of local non-Fermi liquids arising from inter-channel quantum fluctuations. Discontinuous behaviour is observed in several measures of ground state entanglement, signalling the underlying orthogonality catastrophe associated with the degenerate ground state manifold. We extend our results to underscreened and perfectly screened MCK models through duality arguments. A study of channel anisotropy under renormalisation flow reveals a series of quantum phase transitions due to the change in ground state degeneracy. Our work thus presents a template for the study of how a degenerate ground state manifold arising from symmetry and duality properties in a multichannel quantum impurity model can lead to novel multicritical phases at intermediate coupling.

cond-mat.str-el↗

Kondo effect in a non-Hermitian, $\mathcal{PT}$-symmetric Anderson model with Rashba spin-orbit coupling

The non-interacting and non-Hermitian, parity-time ($\mathcal{PT}$)-symmetric Anderson model exhibits an exceptional point (EP) at a non-Hermitian coupling $g=1$, which remains unrenormalized in the presence of interactions (Lourenco et al, arXiv:1806.03116), where the EP was shown to coincide with the quantum critical point (QCP) for Kondo destruction. In this work, we consider a quantum dot hybridizing with metallic leads having Rashba spin-orbit coupling ($λ$). We show that for a non-Hermitian hybridization, $λ$ can renormalize the exceptional point even in the non-interacting case, stabilizing $\mathcal{PT}$-symmetry beyond $g=1$. Through exact diagonalization of a zero-bandwidth, three-site model, we show that the quantum critical point and the exceptional point bifurcate, with the critical point for Kondo destruction at $g_c=1$, and the exceptional coupling being $g_{\scriptscriptstyle{EP}} > 1$ for all $U\neq 0$ and $λ\geq 0; λ\neq U/2$. On the line $λ=U/2$, the critical point and the EP again coincide at $g_c=g_{\scriptscriptstyle{EP}}=1$. The full model with finite bandwidth leads is investigated through the slave-boson approach, using which we show that, in the strong coupling regime, $λ$ and interactions co-operate in strongly reducing the critical point associated with Kondo destruction, below the $λ=0$ value.

cond-mat.str-el↗

Unveiling the Kondo cloud: unitary RG study of the Kondo model

We analyze the single-channel Kondo model using the recently developed unitary renormalization group (URG) method, and obtain a comprehensive understanding of the Kondo screening cloud. The fixed-point low-energy Hamiltonian enables the computation of a plethora of thermodynamic quantities (specific heat, susceptibility, Wilson ratio, etc.) as well as spectral functions, all of which are found to be in excellent agreement with known results. By integrating out the impurity, we obtain an effective Hamiltonian for the excitations of the electrons comprising the Kondo cloud. This is found to contain both k-space number-diagonal (Fermi liquid) as well off-diagonal four-fermion scattering terms. Our conclusions are reinforced by a URG study of the two-particle entanglement and many-body correlations among members of the Kondo cloud and impurity. The entanglement between the impurity and a cloud electron, as well as between any two cloud electrons, is found to increase under flow towards the singlet ground state at the strong-coupling fixed point. Both the number-diagonal and off-diagonal correlations within the conduction cloud are also found to increase as the impurity is screened under the flow, and the latter are found to be responsible for the macroscopic entanglement of the Kondo-singlet ground state. The unitary RG flow enables an analytic computation of the phase shifts suffered by the conduction electrons at the strong-coupling fixed point. This reveals an orthogonality catastrophe between the local moment and strong-coupling ground states, and is related to a change in the Luttinger volume of the conduction bath. Our results offer fresh insight on the nature of the emergent many-particle entanglement within the Kondo cloud, and pave the way for further investigations in more exotic contexts such as the fixed point of the over-screened multi-channel Kondo problem.

cond-mat.str-el↗

Dynamics of valence fluctuations in the extended periodic Anderson model

We have investigated the valence transition in the extended periodic Anderson model (EPAM) within the framework of dynamical mean field theory. Previous theoretical studies have indicated the presence of this transition in parameter ranges that are experimentally inaccessible. In this work, we show that, inclusion of dynamics beyond static mean-field brings the valence transition in physically relevant regimes. We show the strong dependence of the quasiparticle-weight scale across the sharp valence crossover. The density of states also exhibit concomitant large scale spectral weight transfers, which can be observed in experiments.

cond-mat.str-el↗

Non-local corrections to the typical medium theory of Anderson localization

We use the recently developed finite cluster typical medium approach to study the Anderson localization transition in three dimensions. Applying our method to the box and binary alloy disorder distributions, we find a fast convergence with the cluster size. We demonstrate the importance of the typical medium environment and the non-local spatial correlations for the proper characterization of the localization transition. As the cluster size increases, our typical medium cluster method recovers the correct critical disorder strength for the transition. Our findings highlight the importance of the non-local cluster corrections for capturing the localization behavior of the mobility edge trajectories. Our results demonstrate that the typical medium cluster approach developed here provides a consistent and systematic description of the Anderson localization transition in the framework of the effective medium embedding schemes.

cond-mat.dis-nn↗