Effect of Particle-Hole Asymmetry on the Mott-Hubbard Metal-Insulator Transition

The Mott-Hubbard metal-insulator transition is one of the most important problems in correlated electron systems. In the past decade, much progress has been made on examining a particle-hole symmetric form of the transition in the Hubbard model with dynamical mean field theory where it was found that the electronic self energy develops a pole at the transition. We examine the particle-hole asymmetric metal-insulator transition in the Falicov-Kimball model, and find that a number of features change when the noninteracting density of states has a finite bandwidth. Since, generically particle-hole symmetry is broken in real materials, our results have an impact on understanding the metal-insulator transition in real materials.Comment: 5 pages, 3 figure

Strong-Coupling Expansion for the Hubbard Model

A strong-coupling expansion for models of correlated electrons in any dimension is presented. The method is applied to the Hubbard model in $d$ dimensions and compared with numerical results in $d=1$. Third order expansion of the Green function suffices to exhibit both the Mott metal-insulator transition and a low-temperature regime where antiferromagnetic correlations are strong. It is predicted that some of the weak photoemission signals observed in one-dimensional systems such as $SrCuO_2$ should become stronger as temperature increases away from the spin-charge separated state.Comment: 4 pages, RevTex, 3 epsf figures include

Strong-coupling expansions for the anharmonic Holstein model and for the Holstein-Hubbard model

A strong-coupling expansion is applied to the anharmonic Holstein model and to the Holstein-Hubbard model through fourth order in the hopping matrix element. Mean-field theory is then employed to determine transition temperatures of the effective (pseudospin) Hamiltonian. We find that anharmonic effects are not easily mimicked by an on-site Coulomb repulsion, and that anharmonicity strongly favors superconductivity relative to charge-density-wave order. Surprisingly, the phase diagram is strongly modified by relatively small values of the anharmonicity.Comment: 34 pages, typeset in ReVTeX, 11 encapsulated postscript files include

Cluster coherent potential approximation for electronic structure of disordered alloys

We extend the single-site coherent potential approximation (CPA) to include the effects of non-local disorder correlations (alloy short-range order) on the electronic structure of random alloy systems. This is achieved by mapping the original Anderson disorder problem to that of a selfconsistently embedded cluster. This cluster problem is then solved using the equations of motion technique. The CPA is recovered for cluster size $N_{c}=1$, and the disorder averaged density-of-states (DOS) is always positive definite. Various new features, compared to those observed in CPA, and related to repeated scattering on pairs of sites, reflecting the effect of SRO are clearly visible in the DOS. It is explicitly shown that the cluster-CPA method always yields positive-definite DOS. Anderson localization effects have been investigated within this approach. In general, we find that Anderson localization sets in before band splitting occurs, and that increasing partial order drives a continuous transition from an Anderson insulator to an incoherent metal.Comment: 7 pages, 6 figures. submitted to PR

Nuclear Shell Model by the Quantum Monte Carlo Diagonalization Method

The feasibility of shell-model calculations is radically extended by the Quantum Monte Carlo Diagonalization method with various essential improvements. The major improvements are made in the sampling for the generation of shell-model basis vectors, and in the restoration of symmetries such as angular momentum and isospin. Consequently the level structure of low-lying states can be studied with realistic interactions. After testing this method on $^{24}$Mg, we present first results for energy levels and $E2$ properties of $^{64}$Ge, indicating its large and $\gamma$-soft deformation.Comment: 12 pages, RevTex, 2 figures, to be published in Physical Review Letter

Classical Phase Fluctuations in High Temperature Superconductors

Phase fluctuations of the superconducting order parameter play a larger role in the cuprates than in conventional BCS superconductors because of the low superfluid density of a doped insulator. In this paper, we analyze an XY model of classical phase fluctuations in the high temperature superconductors using a low-temperature expansion and Monte Carlo simulations. In agreement with experiment, the value of the superfluid density at temperature T=0 is a quite robust predictor of Tc, and the evolution of the superfluid density with T, including its T-linear behavior at low temperature, is insensitive to microscopic details.Comment: 4 pages, 1 figur

The periodic Anderson model from the atomic limit and FeSi

The exact Green's functions of the periodic Anderson model for $U\to \infty$ are formally expressed within the cumulant expansion in terms of an effective cumulant. Here we resort to a calculation in which this quantity is approximated by the value it takes for the exactly soluble atomic limit of the same model. In the Kondo region a spectral density is obtained that shows near the Fermi surface a structure with the properties of the Kondo peak. Approximate expressions are obtained for the static conductivity $$ and magnetic susceptibility $\chi (T)$ of the PAM, and they are employed to fit the experimental values of FeSi, a compound that behaves like a Kondo insulator with both quantities vanishing rapidly for $T\to 0$. Assuming that the system is in the intermediate valence region, it was possible to find good agreement between theory and experiment for these two properties by employing the same set of parameters. It is shown that in the present model the hybridization is responsible for the relaxation mechanism of the conduction electrons.Comment: 26 pages and 8 figure

Dyson Equation Approach to Many-Body Greens Functions and Self-Consistent RPA, First Application to the Hubbard Model

An approach for particle-hole correlation functions, based on the so-called SCRPA, is developed. This leads to a fully self-consistent RPA-like theory which satisfies the $f$-sum rule and several other theorems. As a first step, a simpler self-consistent approach, the renormalized RPA, is solved numerically in the one-dimensional Hubbard model. The charge and the longitudinal spin susceptibility, the momentum distribution and several ground state properties are calculated and compared with the exact results. Especially at half filling, our approach provides quite promising results and matches the exact behaviour apart from a general prefactor. The strong coupling limit of our approach can be described analytically.Comment: 35 pages, 18 Figures, Feynman diagrams as 10 additional eps-files, revised and enhanced version, accepted in Phys. Rev.

Superconductivity in the quasi-two-dimensional Hubbard model

On the basis of spin and pairing fluctuation-exchange approximation, we study the superconductivity in quasi-two-dimensional Hubbard model. The integral equations for the Green's function are self-consistently solved by numerical calculation. Solutions for the order parameter, London penetration depth, density of states, and transition temperature are obtained. Some of the results are compared with the experiments for the cuprate high-temperature superconductors. Numerical techniques are presented in details. With these techniques, the amount of numerical computation can be greatly reduced.Comment: 17 pages, 13 figure