From d- to p-wave pairing in the t-t' Hubbard model at zero temperature

We develop a DCA(PQMC) algorithm which employs the projective quantum Monte Carlo (PQMC) method for solving the equations of the dynamical cluster approximation (DCA) at zero temperature, and apply it for studying pair susceptibilities of the two-dimensional Hubbard-model with next-nearest neighbor hopping. In particular, we identify which pairing symmetry is dominant in the U-n parameter space (U: repulsive Coulomb interaction; n: electron density). We find that p_{x+y}- (d_{x^2-y^2}-) wave is dominant among triplet (singlet) pairings -at least for 0.3<n<0.8 and U<=4t. The crossover between d_{x^2-y^2}-wave and p_{x+y}-wave occurs around n~0.4.Comment: 5 pages 5 figures; two additional panels in Fig. 2; as to appear in Phys. Rev.

An interactive graphics system to facilitate finite element structural analysis

The characteristics of an interactive graphics systems to facilitate the finite element method of structural analysis are described. The finite element model analysis consists of three phases: (1) preprocessing (model generation), (2) problem solution, and (3) postprocessing (interpretation of results). The advantages of interactive graphics to finite element structural analysis are defined

Thermodynamic and spectral properties of compressed Ce calculated by the merger of the local density approximation and dynamical mean field theory

We have calculated thermodynamic and spectral properties of Ce metal over a wide range of volume and temperature, including the effects of 4f electron correlations, by the merger of the local density approximation and dynamical mean field theory (DMFT). The DMFT equations are solved using the quantum Monte Carlo technique supplemented by the more approximate Hubbard I and Hartree Fock methods. At large volume we find Hubbard split spectra, the associated local moment, and an entropy consistent with degeneracy in the moment direction. On compression through the volume range of the observed gamma-alpha transition, an Abrikosov-Suhl resonance begins to grow rapidly in the 4f spectra at the Fermi level, a corresponding peak develops in the specific heat, and the entropy drops rapidly in the presence of a persistent, although somewhat reduced local moment. Our parameter-free spectra agree well with experiment at the alpha- and gamma-Ce volumes, and a region of negative curvature in the correlation energy leads to a shallowness in the low-temperature total energy over this volume range which is consistent with the gamma-alpha transition. As measured by the double occupancy, we find a noticeable decrease in correlation on compression across the transition; however, even at the smallest volumes considered, Ce remains strongly correlated with residual Hubbard bands to either side of a dominant Fermi-level structure. These characteristics are discussed in light of current theories for the volume collapse transition in Ce.Comment: 19 pages including 14 eps figure

Dynamical Mean-Field Theory - from Quantum Impurity Physics to Lattice Problems

Since the first investigation of the Hubbard model in the limit of infinite dimensions by Metzner and Vollhardt, dynamical mean-field theory (DMFT) has become a very powerful tool for the investigation of lattice models of correlated electrons. In DMFT the lattice model is mapped on an effective quantum impurity model in a bath which has to be determined self-consistently. This approach lead to a significant progress in our understanding of typical correlation problems such as the Mott transition; furthermore, the combination of DMFT with ab-initio methods now allows for a realistic treatment of correlated materials. The focus of these lecture notes is on the relation between quantum impurity physics and the physics of lattice models within DMFT. Issues such as the observability of impurity quantum phase transitions in the corresponding lattice models are discussed in detail.Comment: 18 pages, 5 figures, invited paper for the Proceedings of the "3rd International Summer School on Strongly Correlated Systems, Debrecen, 2004

Orbital-selective Mott-Hubbard transition in the two-band Hubbard model

Recent advances in the field of quantum Monte Carlo simulations for impurity problems allow --within dynamical mean field theory-- for a more thorough investigation of the two-band Hubbard model with narrow/wide band and SU(2)-symmetric Hund's exchange. The nature of this transition has been controversial, and we establish that an orbital-selective Mott-Hubbard transition exists. Thereby, the wide band still shows metallic behavior after the narrow band became insulating -not a pseudogap as for an Ising Hund's exchange. The coexistence of two solutions with metallic wide band and insulating or metallic narrow band indicates, in general, first-order transitions.Comment: 4 pages, 3 figures; 2nd version as published in Phys. Rev. B (R); minor corrections, putting more emphasis on differences in spectra when comparing SU(2) and Ising Hund's exchang