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arXiv:cond-mat/0105564 · Physical review. B, Condensed matter

Violation of the Fermi-liquid picture in two-dimensional systems owing to Van Hove singularities

V. Yu. Irkhin, A. A. Katanin

Published Oct 31, 2001• 11 citations
arXivHTMLPDF

Abstract

We consider the two-dimensional $t\ensuremath{-}{t}^{\ensuremath{'}}$ Hubbard model with the Fermi level being close to Van Hove singularities. The phase diagram of the model is discussed. Far from the quantum phase transition (QPT) into ferro- (antiferro-) magnetic states, the self-energy at the singularity points has a nearly linear energy dependence, the density of states being proportional to ${\mathrm{ln}}^{3}|\ensuremath{\varepsilon}|.$ In the quantum-disordered and quantum-critical regimes near the QPT a scaling approach is used. At small energies the self-energy demonstrates a powerlike behavior with the exponent changing from unity to zero in a narrow energy interval. Provided that the system is close to ferromagnetic instability which occurs at ${t}^{\ensuremath{'}}/\stackrel{\ensuremath{\rightarrow}}{t}\ensuremath{-}1/2,$ the quasiparticle spectral weight has, instead of a narrow peak, a broad maximum and is nonmonotonous at small energies. The application of the results to cuprates is discussed.

DOI
10.1103/physrevb.64.205105

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We consider the two-dimensional t\ensuremath−t\ensuremath′t\ensuremath{-}{t}^{\ensuremath{'}}t\ensuremath−t\ensuremath′ Hubbard model with the Fermi level being close to Van Hove singularities. The phase diagram of the model is discussed. Far from the quantum phase transition (QPT) into ferro- (antiferro-) magnetic states, the self-energy at the singularity points has a nearly linear energy dependence, the density of states being proportional to ln3∣\ensuremathε∣.{\mathrm{ln}}^{3}|\ensuremath{\varepsilon}|.ln3∣\ensuremathε∣. In the quantum-disordered and quantum-critical regimes near the QPT a scaling approach is used. At small energies the self-energy demonstrates a powerlike behavior with the exponent changing from unity to zero in a narrow energy interval. Provided that the system is close to ferromagnetic instability which occurs at t\ensuremath′/t\ensuremath→\ensuremath−1/2,{t}^{\ensuremath{'}}/\stackrel{\ensuremath{\rightarrow}}{t}\ensuremath{-}1/2,t\ensuremath′/t\ensuremath→​\ensuremath−1/2, the quasiparticle spectral weight has, instead of a narrow peak, a broad maximum and is nonmonotonous at small energies. The application of the results to cuprates is discussed.
When a van Hove singularity is located in the vicinity of the Fermi level, the electronic scattering rate acquires a nonanalytic contribution. This invalidates basic assumptions of Fermi liquid theory and within treatments based on perturbation theory leads to a non-Fermi liquid self-energy and transport properties. Such anomalies are shown to also occur in the strongly correlated metallic state within dynamical mean-field theory. We consider the Hubbard model on a two-dimensional square lattice with nearest- and next-nearest-neighbor hoppings within the single-site dynamical mean-field theory. At temperatures on the order of the low-energy scale T0{T}_{0}T0​ an unusual maximum emerges in the imaginary part of the self-energy which is renormalized toward the Fermi level for finite doping. At zero temperature this double-well structure is suppressed but an anomalous energy dependence of the self-energy remains. For the frustrated Hubbard model on the square lattice with next-nearest-neighbor hopping, the presence of the van Hove singularity changes the asymptotic low-temperature behavior of the resistivity from a Fermi liquid to non-Fermi liquid dependency as function of doping. The results of this work are discussed regarding their relevance for high-temperature cuprate superconductors.
We use a diagrammatic approach to study low-energy physics of a two-dimensional electron system where the Fermi level is near van Hove singularities in the energy spectrum. We find that in most regions of the ${\ensuremath{\epsilon}}_{F}\ensuremath{-}T$ phase diagram the system behaves as a normal Fermi liquid rather than a marginal Fermi liquid. Particularly, the imaginary part of the self-energy is much smaller than the excitation energy, which implies well-defined quasiparticle excitations, and single-particle properties are only weakly affected by the presence of the van Hove singularities. The relevance to high-temperature superconductivity is also discussed.
Using large-scale dynamical cluster quantum Monte Carlo simulations, we study the Lifshitz transition of the two-dimensional Hubbard model with next-nearest-neighbor hopping (${t}^{\ensuremath{'}}$), chemical potential, and temperature as control parameters. At ${t}^{\ensuremath{'}}\ensuremath{\le}0$, we identify a line of Lifshitz transition points associated with a change in the Fermi surface topology at zero temperature. In the overdoped region, the Fermi surface is complete and electron-like; across the Lifshitz transition, the Fermi surface becomes hole-like and develops a pseudogap. At (or very close to) the Lifshitz transition points, a van Hove singularity in the density of states crosses the Fermi level. The van Hove singularity occurs at finite doping due to correlation effects and becomes more singular when ${t}^{\ensuremath{'}}$ becomes more negative. The resulting temperature dependence on the bare ddd-wave pairing susceptibility close to the Lifshitz points is significantly different from that found in the traditional van Hove scenarios. Such unambiguous numerical observation of the Lifshitz transition at ${t}^{\ensuremath{'}}\ensuremath{\le}0$ extends our understanding of the quantum critical region in the phase diagram and shines lights on future investigations of the nature of the quantum critical point in the two-dimensional Hubbard model.
A quantum critical point is found in the phase diagram of the two-dimensional Hubbard model [Vidhyadhiraja et al., Phys. Rev. Lett. 102, 206407 (2009)]. It is due to the vanishing of the critical temperature associated with a phase-separation transition, and it separates the non-Fermi-liquid region from the Fermi liquid. Near the quantum critical point, the pairing is enhanced since the real part of the bare ddd-wave pairing susceptibility exhibits an algebraic divergence with decreasing temperature, replacing the logarithmic divergence found in a Fermi liquid [Yang et al., Phys. Rev. Lett. 106, 047004 (2011)]. In this paper, we explore the single-particle and transport properties near the quantum critical point using high-quality estimates of the self-energy obtained by direct analytic continuation of the self-energy from the continuous-time quantum Monte Carlo method. We focus mainly on a van Hove singularity coming from the relatively flat dispersion that crosses the Fermi level near the quantum critical filling. The flat part of the dispersion orthogonal to the antinodal direction remains pinned near the Fermi level for a range of doping that increases when we include a negative next-near-neighbor hopping ${t}^{\ensuremath{'}}$ in the model. For comparison, we calculate the bare ddd-wave pairing susceptibility for noninteracting models with the usual two-dimensional tight-binding dispersion and a hypothetical quartic dispersion. We find that neither model yields a van Hove singularity that completely describes the critical algebraic behavior of the bare ddd-wave pairing susceptibility found in the numerical data. The resistivity, thermal conductivity, thermopower, and the Wiedemann-Franz law are examined in the Fermi liquid, marginal Fermi liquid, and pseudogap doping regions. A negative next-near-neighbor hopping ${t}^{\ensuremath{'}}$ increases the doping region with marginal Fermi liquid character. Both TTT and negative ${t}^{\ensuremath{'}}$ are relevant variables for the quantum critical point, and both the transport and the displacement of the van Hove singularity with filling suggest that they are qualitatively similar in their effect.
We examine the quasiparticle lifetime and spectral weight near the Fermi surface in the two-dimensional Hubbard model. We use the FLEX approximation to self-consistently generate the Matsubara Green's functions and then we analytically continue to the real axis to obtain the quasiparticle spectral functions. We compare the spectral functions found in the nearest neighbor hopping only Hubbard model with those found when second neighbor hopping is included. This separates the effects of nesting, the Van Hove singularity and the short-ranged antiferromagnetic correlations. The quasiparticle scattering rate is enhanced along the (0,pi) to (pi,pi) Brillouin zone diagonal. When the density is close to half-filling these 'hot-spots' lie on the Fermi surface and the scattering rate increases with decreasing temperature. For the next-nearest neighbor hopping scenario we observe a large range of doping where there is no antiferromagnetism but the scattering rate has a linear temperature dependence. On decreasing the interaction this non-Fermi liquid behavior is confined to doping levels where the Fermi energy lies near to the Van Hove singularity. We conclude that the 'hot-spots' are associated with the antiferromagnetic phase transition while the linear temperature dependence of the scattering rate is associated with the Van Hove singularity.
Using the dynamical mean-field theory (DMFT) with the numerical renormalization-group impurity solver we study the paramagnetic phase of the Hubbard model with the density of states (DOS) corresponding to the three-dimensional (3D) cubic lattice and the two-dimensional (2D) square lattice, as well as a DOS with inverse square-root singularity. We show that the electron correlations rapidly smooth out the square-root van Hove singularities (kinks) in the spectral function for the 3D lattice and that the Mott metal-insulator transition (MIT) as well as the magnetic-field-induced MIT differ only little from the well-known results for the Bethe lattice. The consequences of the logarithmic singularity in the DOS for the 2D lattice are more dramatic. At half filling, the divergence pinned at the Fermi level is not washed out, only its integrated weight decreases as the interaction is increased. While the Mott transition is still of the usual kind, the magnetic-field-induced MIT falls into a different universality class as there is no field-induced localization of quasiparticles. In the case of a power-law singularity in the DOS at the Fermi level, the power-law singularity persists in the presence of interaction, albeit with a different exponent, and the effective impurity model in the DMFT turns out to be a pseudogap Anderson impurity model with a hybridization function which vanishes at the Fermi level. The system is then a generalized Fermi liquid. At finite doping, regular Fermi-liquid behavior is recovered.