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arXiv:1910.13643 · Physical Review Letters

Global Phase Diagram of a Spin-Orbital Kondo Impurity Model and the Suppression of Fermi-Liquid Scale

Yilin Wang, Elias Walter, Seung‐Sup B. Lee, K. M. Stadler, Jan von Delft, Andreas Weichselbaum, Gabriel Kotliar

Published Apr 3, 2020• 17 citations
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Abstract

Many correlated metallic materials are described by Landau Fermi-liquid theory at low energies, but for Hund metals the Fermi-liquid coherence scale T_{FL} is found to be surprisingly small. In this Letter, we study the simplest impurity model relevant for Hund metals, the three-channel spin-orbital Kondo model, using the numerical renormalization group (NRG) method and compute its global phase diagram. In this framework, T_{FL} becomes arbitrarily small close to two new quantum critical points that we identify by tuning the spin or spin-orbital Kondo couplings into the ferromagnetic regimes. We find quantum phase transitions to a singular Fermi-liquid or a novel non-Fermi-liquid phase. The new non-Fermi-liquid phase shows frustrated behavior involving alternating overscreenings in spin and orbital sectors, with universal power laws in the spin (ω^{-1/5}), orbital (ω^{1/5}) and spin-orbital (ω^{1}) dynamical susceptibilities. These power laws, and the NRG eigenlevel spectra, can be fully understood using conformal field theory arguments, which also clarify the nature of the non-Fermi-liquid phase.

DOI
10.1103/physrevlett.124.136406

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Quantum phase transitions of metals involve changes in the Fermi surface, and can be divided into three categories. The first two categories involve symmetry breaking, and lead to a deformation or reconstruction of the Fermi surface. The third category involves a change in the volume enclosed by the Fermi surface without any symmetry breaking: one phase is a Fermi liquid (FL) with the conventional Luttinger volume, while the other phase is a `fractionalized Fermi liquid' (FL*), which has a non-Luttinger volume Fermi surface accompanied by a spin liquid with fractionalized excitations. It is a relatively simple matter to obtain a FL*-FL transition in Kondo lattice models. However, the FL*-FL transition can also be present in single-band Hubbard-like models: this is efficiently described by the `ancilla' method, which shows that the transition is a `flipped' Kondo lattice transition. This single-band FL*-FL transition is argued to apply to the metallic states of the hole-doped cuprates. In the clean limit, the critical properties of the quantum transitions in the three categories are distinct, but all lead to perfect metal transport in the quantum-critical regime. Impurity-induced `Harris disorder', with spatial fluctuations in the local position of the quantum critical point, is a relevant perturbation to the clean critical points. In the presence of Harris disorder, all three categories exhibit strange metal behavior, which can be described by a universal two-dimensional Yukawa-Sachdev-Ye-Kitaev model.

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Many correlated metallic materials are described by Landau Fermi-liquid theory at low energies, but for Hund metals the Fermi-liquid coherence scale T_{FL} is found to be surprisingly small. In this Letter, we study the simplest impurity model relevant for Hund metals, the three-channel spin-orbital Kondo model, using the numerical renormalization group (NRG) method and compute its global phase diagram. In this framework, T_{FL} becomes arbitrarily small close to two new quantum critical points that we identify by tuning the spin or spin-orbital Kondo couplings into the ferromagnetic regimes. We find quantum phase transitions to a singular Fermi-liquid or a novel non-Fermi-liquid phase. The new non-Fermi-liquid phase shows frustrated behavior involving alternating overscreenings in spin and orbital sectors, with universal power laws in the spin (ω^{-1/5}), orbital (ω^{1/5}) and spin-orbital (ω^{1}) dynamical susceptibilities. These power laws, and the NRG eigenlevel spectra, can be fully understood using conformal field theory arguments, which also clarify the nature of the non-Fermi-liquid phase.
Hund metals have attracted attention in recent years due to their unconventional superconductivity, which supposedly originates from non-Fermi-liquid (NFL) properties of the normal state.When studying Hund metals using dynamical mean-field theory, one arrives at a self-consistent "Hund impurity problem" involving a multiorbital quantum impurity with nonzero Hund coupling interacting with a metallic bath.If its spin and orbital degrees of freedom are screened at different energy scales, T sp < T orb , the intermediate energy window is governed by a novel NFL fixed point, whose nature had not yet been clarified.We resolve this problem by providing an analytical solution of a paradigmatic example of a Hund impurity problem, involving two spin and three orbital degrees of freedom.To this end, we combine a state-ofthe-art implementation of the numerical renormalization group, capable of exploiting non-Abelian symmetries, with a generalization of Affleck and Ludwig's conformal field theory (CFT) approach for multichannel Kondo models.We characterize the NFL fixed point of Hund metals in detail for a Kondo model with an impurity forming an SUð2Þ × SUð3Þ spin-orbital multiplet, tuned such that the NFL energy window is very wide.The impurity's spin and orbital susceptibilities then exhibit striking power-law behavior, which we explain using CFT arguments.We find excellent agreement between CFT predictions and numerical renormalization group results.Our main physical conclusion is that the regime of spinorbital separation, where orbital degrees of freedom have been screened but spin degrees of freedom have not, features anomalously strong local spin fluctuations: the impurity susceptibility increases as χ imp sp ∼ ω -γ , with γ > 1.
We discuss the two-channel Kondo problem with a pseudogap density of states $\ensuremath{\rho}(\ensuremath{\omega})\ensuremath{\propto}{|\ensuremath{\omega}|}^{r}$ of the bath fermions. Combining both analytical and numerical renormalization group techniques, we characterize the impurity phases and quantum phase transitions of the relevant Kondo and Anderson models. The line of stable points, corresponding to the overscreened non-Fermi-liquid behavior of the metallic r=0r=0r=0 case, is replaced by a stable particle-hole-symmetric intermediate-coupling fixed point for $0<r<{r}_{\mathrm{max}}\ensuremath{\approx}0.23$. For r>rmaxr>{r}_{\mathrm{max}}r>rmax​, this non-Fermi-liquid phase disappears, and instead a critical fixed point with an emergent spin-channel symmetry appears, controlling the quantum phase transition between two phases with stable spin and channel moments, respectively. We propose low-energy field theories to describe the quantum phase transitions, all being formulated in fermionic variables. We employ $\ensuremath{\epsilon}$ expansion techniques to calculate critical properties near the critical dimensions r=0r=0r=0 and 1, the latter being potentially relevant for two-channel Kondo impurities in neutral graphene. We find the analytical results to be in excellent agreement with those obtained from applying Wilson's numerical renormalization group technique.
We study how the non-Fermi-liquid nature of the overscreened multichannel Kondo impurity model affects the response to a BCS pairing term that, in the absence of the impurity, opens a gap $\mathrm{\ensuremath{\Delta}}$. We find that the low-energy spectrum in the limit $\mathrm{\ensuremath{\Delta}}\ensuremath{\rightarrow}0$ actually does not correspond to the spectrum strictly at $\mathrm{\ensuremath{\Delta}}=0$. In particular, in the two-channel Kondo model, the $\mathrm{\ensuremath{\Delta}}\ensuremath{\rightarrow}0$ ground state is an orbitally degenerate spin singlet, while it is an orbital singlet with a residual spin degeneracy at $\mathrm{\ensuremath{\Delta}}=0$. In addition, there are fractionalized spin-1/2 subgap excitations whose energy in units of $\mathrm{\ensuremath{\Delta}}$ tends toward a finite and universal value when $\mathrm{\ensuremath{\Delta}}\ensuremath{\rightarrow}0$, as if the universality of the anomalous power-law exponents that characterize the overscreened Kondo effect turned into universal energy ratios when the scale invariance is broken by $\mathrm{\ensuremath{\Delta}}\ensuremath{\ne}0$. This intriguing phenomenon can be explained by the renormalization flow toward the overscreened fixed point and the gap cutting off the orthogonality catastrophe singularities. We also find other non-Fermi-liquid features at finite $\mathrm{\ensuremath{\Delta}}$: the local density of states lacks coherence peaks, the states in the continuum above the gap are unconventional, and the boundary entropy is a nonmonotonic function of temperature. The persistent subgap excitations are characteristic of the non-Fermi-liquid fixed point of the model, and thus depend on the impurity spin and the number of screening channels.
A multichannel Kondo model, where two or more equivalent but independent channels of electrons compete to screen a spin-12\frac{1}{2}21​ impurity, shows overcompensation of the impurity spin, leading to the non-Fermi-liquid behavior in various thermodynamic and transport properties. However, when the channel symmetry is broken, an impurity quantum phase transition can occur at zero temperature. Identification of an order parameter describing the impurity quantum phase transition is very difficult since it is beyond the conventional Landau-Ginzburg-Wilson theory. By employing the natural orbitals renormalization group method, we study both two-channel and three-channel Kondo models, from the perspective of spin correlation between the impurity and electrons in electronic channels. Here we demonstrate that by introducing the spin-correlation ratio as an order parameter we can characterize impurity quantum phase transitions driven by channel asymmetry. In particular, the universal critical exponents $\ensuremath{\beta}$ of the spin-correlation ratio and $\ensuremath{\nu}$ of the correlation length are explicitly determined by finite-size-scaling analysis, namely, $\ensuremath{\beta}=0.10(1)$ and $\ensuremath{\nu}=2.0(1)$, and $\ensuremath{\beta}=0.10(1)$ and $\ensuremath{\nu}=2.5(1)$ for the two-channel and three-channel Kondo models, respectively.
We generalize Nozi\`eres' Fermi-liquid theory for the low-energy behavior of the Kondo model to that of the single-impurity Anderson model. In addition to the electrons' phase shift at the Fermi energy, the low-energy Fermi-liquid theory is characterized by four Fermi-liquid parameters: the two given by Nozi\`eres that enter to first order in the excitation energy, and two additional ones that enter to second order and are needed away from particle-hole symmetry. We express all four parameters in terms of zero-temperature physical observables, namely the local charge and spin susceptibilities and their derivatives with respect to the local level position. We determine these in terms of the bare parameters of the Anderson model using Bethe ansatz and numerical renormalization group (NRG) calculations. Our low-energy Fermi-liquid theory applies throughout the crossover from the strong-coupling Kondo regime via the mixed-valence regime to the empty-orbital regime. From the Fermi-liquid theory, we determine the conductance through a quantum dot symmetrically coupled to two leads in the regime of small magnetic field, low temperature, and small bias voltage, and compute the coefficients of the $\ensuremath{\sim}{B}^{2}, \ensuremath{\sim}{T}^{2}$, and $\ensuremath{\sim}{V}^{2}$ terms exactly in terms of the Fermi-liquid parameters. The coefficients of T2,V2{T}^{2}, {V}^{2}T2,V2, and B2{B}^{2}B2 are found to change sign during the Kondo to empty-orbital crossover. The crossover becomes universal in the limit that the local interaction is much larger than the level width. For completeness, we also compute the shot noise and discuss the resulting Fano factor.
Quantum phase transitions of metals involve changes in the Fermi surface, and can be divided into three categories. The first two categories involve symmetry breaking, and lead to a deformation or reconstruction of the Fermi surface. The third category involves a change in the volume enclosed by the Fermi surface without any symmetry breaking: one phase is a Fermi liquid (FL) with the conventional Luttinger volume, while the other phase is a `fractionalized Fermi liquid' (FL*), which has a non-Luttinger volume Fermi surface accompanied by a spin liquid with fractionalized excitations. It is a relatively simple matter to obtain a FL*-FL transition in Kondo lattice models. However, the FL*-FL transition can also be present in single-band Hubbard-like models: this is efficiently described by the `ancilla' method, which shows that the transition is a `flipped' Kondo lattice transition. This single-band FL*-FL transition is argued to apply to the metallic states of the hole-doped cuprates. In the clean limit, the critical properties of the quantum transitions in the three categories are distinct, but all lead to perfect metal transport in the quantum-critical regime. Impurity-induced `Harris disorder', with spatial fluctuations in the local position of the quantum critical point, is a relevant perturbation to the clean critical points. In the presence of Harris disorder, all three categories exhibit strange metal behavior, which can be described by a universal two-dimensional Yukawa-Sachdev-Ye-Kitaev model.