Fluctuation Exchange Analysis of Superconductivity in the Standard Three-Band CuO2 Model

The fluctuation exchange, or FLEX, approximation for interacting electrons is applied to study instabilities in the standard three-band model for CuO2 layers in the high-temperature superconductors. Both intra-orbital and near-neigbor Coulomb interactions are retained. The filling dependence of the d(x2-y2) transition temperature is studied in both the "hole-doped" and "electron-doped" regimes using parameters derived from constrained-occupancy density-functional theory for La2CuO4. The agreement with experiment on the overdoped hole side of the phase diagram is remarkably good, i.e., transitions emerge in the 40 K range with no free parameters. In addition the importance of the "orbital antiferromagnetic," or flux phase, charge density channel is emphasized for an understanding of the underdoped regime.Comment: REVTex and PostScript, 31 pages, 26 figures; to appear in Phys. Rev. B (1998); only revised EPS figures 3, 4, 6a, 6b, 6c, 7 and 8 to correct disappearance of some labels due to technical problem

Towards analytic description of a transition from weak to strong coupling regime in correlated electron systems. I. Systematic diagrammatic theory with two-particle Green functions

We analyze behavior of correlated electrons described by Hubbard-like models at intermediate and strong coupling. We show that with increasing interaction a pole in a generic two-particle Green function is approached. The pole signals metal-insulator transition at half filling and gives rise to a new vanishing ``Kondo'' scale causing breakdown of weak-coupling perturbation theory. To describe the critical behavior at the metal-insulator transition a novel, self-consistent diagrammatic technique with two-particle Green functions is developed. The theory is based on the linked-cluster expansion for the thermodynamic potential with electron-electron interaction as propagator. Parquet diagrams with a generating functional are derived. Numerical instabilities due to the metal-insulator transition are demonstrated on simplifications of the parquet algebra with ring and ladder series only. A stable numerical solution in the critical region is reached by factorization of singular terms via a low-frequency expansion in the vertex function. We stress the necessity for dynamical vertex renormalizations, missing in the simple approximations, in order to describe the critical, strong-coupling behavior correctly. We propose a simplification of the full parquet approximation by keeping only most divergent terms in the asymptotic strong-coupling region. A qualitatively new, feasible approximation suitable for the description of a transition from weak to strong coupling is obtained.Comment: 17 pages, 4 figures, REVTe

The Superconducting Instabilities of the non half-filled Hubbard Model in Two Dimensions

The problem of weakly correlated electrons on a square lattice is formulated in terms of one-loop renormalization group. Starting from the action for the entire Brillouin zone (and not with a low-energy effective action) we reduce successively the cutoff $\Lambda$ about the Fermi surface and follow the renormalization of the coupling $U$ as a function of three energy-momenta. We calculate the intrinsic scale $T_{co}$ where the renormalization group flow crosses over from the regime ($\Lambda > T_{co}$) where the electron-electron (e-e) and electron-hole (e-h) terms are equally important to the regime ($\Lambda < T_{co}$) where only the e-e term plays a role. In the low energy regime only the pairing interaction $V$ is marginally relevant, containing contributions from all renormalization group steps of the regime $\Lambda > T_{co}$. After diagonalization of $V_{\Lambda =T_{co}}$, we identify its most attractive eigenvalue $\lambda _{\min}$. At low filling, $\lambda _{\min}$ corresponds to the $B_2$ representation ($d_{xy}$ symmetry), while near half filling the strongest attraction occurs in the $B_1$ representation ($d_{x^2-y^2}$ symmetry). In the direction of the van Hove singularities, the order parameter shows peaks with increasing strength as one approaches half filling. Using the form of pairing and the structure of the renormalization group equations in the low energy regime, we give our interpretation of ARPES experiments trying to determine the symmetry of the order parameter in the Bi2212 high-$T_{c}$ compound.Comment: 24 pages (RevTeX) + 11 figures (the tex file appeared incomplete

Knight Shift Anomalies in Heavy Electron Materials

We calculate non-linear Knight Shift $K$ vs. susceptibility $\chi$ anomalies for Ce ions possessing local moments in metals. The ions are modeled with the Anderson Hamiltonian and studied within the non-crossing approximation (NCA). The $K-vs.- \chi$ non-linearity diminishes with decreasing Kondo temperature $T_0$ and nuclear spin- local moment separation. Treating the Ce ions as an incoherent array in CeSn$_3$, we find excellent agreement with the observed Sn $K(T)$ data.Comment: 4 pages, Revtex, 3 figures available upon request from [email protected]

Fourth Order Perturbation Theory for Normal Selfenergy in Repulsive Hubbard Model

We investigate the normal selfenergy and the mass enhancement factor in the Hubbard model on the two-dimensional square lattice. Our purpose in this paper is to evaluate the mass enhancement factor more quantitatively than the conventional third order perturbation theory. We calculate it by expanding perturbatively up to the fourth order with respect to the on-site repulsion $U$. We consider the cases that the system is near the half-filling, which are similar situations to high-$T_c$ cuprates. As results of the calculations, we obtain the large mass enhancement on the Fermi surface by introducing the fourth order terms. This is mainly originated from the fourth order particle-hole and particle-particle diagrams. Although the other fourth order terms have effect of reducing the effective mass, this effect does not cancel out the former mass enhancement completely and there remains still a large mass enhancement effect. In addition, we find that the mass enhancement factor becomes large with increasing the on-site repulsion $U$ and the density of state (DOS) at the Fermi energy $\rho(0)$. According to many current reseaches, such large $U$ and $\rho(0)$ enhance the effective interaction between quasiparticles, therefore the superconducting transition temperature $T_c$ increases. On the other hand, the large mass enhancement leads the reduction of the energy scale of quasiparticles, as a result, $T_c$ is reduced. When we discuss $T_c$, we have to estimate these two competitive effects.Comment: 6pages,8figure

Effects of Spin Fluctuations in Quasi-One-Dimensional Organic Superconductors

We study the electronic states of quasi-one-dimensional organic conductors using the single band Hubbard model at half-filling. We treat the effects of the on-site Coulomb interaction by the fluctuation-exchange (FLEX) method, and calculate the phase diagram and physical properties. The calculated pressure dependence of the Neel temperature coincides well with the experimental one. We also show that a pseudogap is formed in the density of states near the chemical potential and that d-wave superconductivity appears next to the antiferromagnetic state. Moreover the NMR relaxation rate increases on cooling in the low-temperature region.Comment: 4 pages, 5 figures, to apprear in J. Phys. Soc. Jp

An electron correlation originated negative magnetoresistance in a system having a partly flat band

Inspired from an experimentally examined organic conductor, a novel mechanism for negative magnetoresistance is proposed for repulsively interacting electrons on a lattice whose band dispersion contains a flat portion (a flat bottom below a dispersive part here). When the Fermi level lies in the flat part, the electron correlation should cause ferromagnetic spin fluctuations to develop with an enhanced susceptibility. A relatively small magnetic field will then shift the majority-spin Fermi level to the dispersive part, resulting in a negative magnetoresistance. We have actually confirmed the idea by calculating the conductivity in magnetic fields, with the fluctuation exchange approximation, for the repulsive Hubbard model on a square lattice having a large second nearest-neighbor hopping.Comment: RevTex, 5 figures in Postscript, to be published in Phys. Rev.

Andreev Scattering and the Kondo Effect

We examine the properties of an infinite-$U$ Anderson impurity coupled to both normal and superconducting metals. Both the cases of a quantum dot and a quantum point contact containing an impurity are considered; for the latter, we study both one and two-channel impurities. Using a generalization of the noncrossing approximation which incorporates multiple Andreev reflection, we compute the impurity spectral function and the linear-response conductance of these devices. We find generically that the Kondo resonance develops structure at energies corresponding to the superconducting gap, and that the magnitude of the resonance at the Fermi energy is altered. This leads to observable changes in the zero-bias conductance as compared to the case with no superconductivity.Comment: 8 pages, 7 figures; expanded version to appear in PR

Reduction of Tc due to Impurities in Cuprate Superconductors

In order to explain how impurities affect the unconventional superconductivity, we study non-magnetic impurity effect on the transition temperature using on-site U Hubbard model within a fluctuation exchange (FLEX) approximation. We find that in appearance, the reduction of Tc roughly coincides with the well-known Abrikosov-Gor'kov formula. This coincidence results from the cancellation between two effects; one is the reduction of attractive force due to randomness, and another is the reduction of the damping rate of quasi-particle arising from electron interaction. As another problem, we also study impurity effect on underdoped cuprate as the system showing pseudogap phenomena. To the aim, we adopt the pairing scenario for the pseudogap and discuss how pseudogap phenomena affect the reduction of Tc by impurities. We find that 'pseudogap breaking' by impurities plays the essential role in underdoped cuprate and suppresses the Tc reduction due to the superconducting (SC) fluctuation.Comment: 14 pages, 28 figures To be published in JPS

Spin-Dependent Mass Enhancement under Magnetic Field in the Periodic Anderson Model

In order to study the mechanism of the mass enhancement in heavy fermion compounds in the presence of magnetic field, we study the periodic Anderson model using the fluctuation exchange approximation. The resulting value of the mass enhancement factor z^{-1} can become up to 10, which is significantly larger than that in the single-band Hubbard model. We show that the difference between the magnitude of the mass enhancement factor of up spin (minority spin) electrons z^{-1}_up and that of down spin (majority spin) electrons z^{-1}_down increases by the applied magnetic field B//z, which is consistent with de Haas-van Alphen measurements for CeCoIn_5, CeRu_2Si_2 and CePd_2Si_2. We predict that z^{-1}_up >z^{-1}_down in many Ce compounds, whereas z^{-1}_up < z^{-1}_down in Yb compounds.Comment: 5 pages, 4 figure