The temperature dependence of the spectral properties and of the Fermi surface of hole-doped 2-D Hubbard model with anisotropic nearest-neighbor hopping is evaluated using the perturbation theory. The anomalous spectral features are mainly due to the proximity of van Hove singularities to the Fermi energy.
The zero-temperature spectral properties and Fermi surface (FS) anomalies of hole-doped 2D Hubbard model with anisotropic nearest-neighbor hopping are evaluated using the perturbation theory. The nested sections of the FS, which are always present in the anisotropic model, are found to expand with the strength of Coulomb correlation U. The renormalized FS and the low-energy part of the density of states obtained for small anisotropy and large U are similar to those obtained for large anisotropy and small U. The effect of correlation at low doping can best be described as an enhancement of the hopping anisotropy. The anomalous spectral features are mainly due to the van Hove singularities, which give rise to the momentum dependence of the self-energy.
The single-particle spectral properties near the Mott transition in the two-dimensional Hubbard model with next-nearest-neighbor hopping are investigated by using cluster perturbation theory. Complicated spectral features of this model are simply interpreted, by considering how the next-nearest-neighbor hopping shifts the spectral weights of the two-dimensional Hubbard model. Various anomalous features observed in hole-doped and electron-doped cuprate high-temperature superconductors are explained in a unified manner as properties near the Mott transition in a two-dimensional system whose spectral weights are shifted by next-nearest-neighbor hopping.
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.
The self-energy of the hole-doped two-dimensional (2D) Hubbard model is calculated to second order in the interaction U and the ensuing renormalization of the spectral properties and of the Fermi surface is discussed. In uncorrelated systems the square-shaped Fermi surface separates the Fermi surface closed around the \ensuremath{\Gamma} point (with more holes than particles) from the Fermi surface closed around the Z point (with more particles than holes). In a correlated system a topological change from a Fermi surface centered around the \ensuremath{\Gamma} point to a Fermi surface closed around a Z point is induced, either by increasing the interaction or by diminishing the concentration of holes. The shape of the renormalized spectral function Ap(\ensuremath{\omega}) is momentum dependent. Using Ap(\ensuremath{\omega}) we evaluate dispersion of single-particle excitations. At low energies the band of quasiparticles with reduced bandwidth is clearly seen. At high energies and far away from the Fermi surface the spectra acquire an additional peak that describes excitations in the Hubbard band. The dispersion in Hubbard bands is weaker along the \ensuremath{\Gamma}-Z, than \ensuremath{\Gamma}-X or X-Z direction. The density of states of a correlated system, as given by the perturbation theory, remains logarithmically singular but the singular weight is reduced with respect to the uncorrelated one. In addition, the correlations transfer the spectral weight out of the low-energy region, where only a narrow Kondo-like structure seems to remain. The spectral properties of the 2D Hubbard model obtained by the truncated perturbation expansion resemble in many ways the recent experimental data on metallic cuprates.
The temperature-dependent self-energy of the hole-doped two-dimensional Hubbard model is calculated perturbatively up to second order and used to find the spectral function for all points in the Brillouin zone. Single-particle dispersion, density of states, and Fermi surface topology are thus obtained and the appearance of the strong-coupling features studied. The renormalized quantities are temperature dependent due to an interplay between the electron correlation and topology of free-electron bands close to the Fermi energy.
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 d-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.