Dynamics of the Hubbard model: a general approach by time dependent variational principle

We describe the quantum dynamics of the Hubbard model at semi-classical level, by implementing the Time-Dependent Variational Principle (TDVP) procedure on appropriate macroscopic wavefunctions constructed in terms of su(2)-coherent states. Within the TDVP procedure, such states turn out to include a time-dependent quantum phase, part of which can be recognized as Berry's phase. We derive two new semi-classical model Hamiltonians for describing the dynamics in the paramagnetic, superconducting, antiferromagnetic and charge density wave phases and solve the corresponding canonical equations of motion in various cases. Noticeably, a vortex-like ground state phase dynamics is found to take place for U>0 away from half filling. Moreover, it appears that an oscillatory-like ground state dynamics survives at the Fermi surface at half-filling for any U. The low-energy dynamics is also exactly solved by separating fast and slow variables. The role of the time-dependent phase is shown to be particularly interesting in the ordered phases.Comment: ReVTeX file, 38 pages, to appear on Phys. Rev.

Symmetry Properties on Magnetization in the Hubbard Model at Finite Temperatures

By making use of some symmetry properties of the relevant Hamiltonian, two fundamental relations between the ferromagnetic magnetization and a spin correlation function are derived for the $d (=1,2,3)$-dimensional Hubbard model at finite temperatures. These can be viewed as a kind of Ward-Takahashi identities. The properties of the magnetization as a function of the applied field are discussed. The results thus obtained hold true for both repulsive and attractive on-site Coulomb interactions, and for arbitrary electron fillings.Comment: Latex file, no figur

Finite-temperature properties of the Hubbard chain with bond-charge interaction

We investigate the one-dimensional Hubbard model with an additional bond-charge interaction, recently considered in the description of compounds that exhibit strong 1D features above the temperature of ordered phases. The partition function of the model is exactly calculated for a value of the bond-charge coupling; the behavior of the specific heat and spin susceptibility as a function of temperature is derived at arbitrary filling, and particularly discussed across the occurring metal-insulator transition. The results show that the bond-charge terms weaken the spin excitations of the system.Comment: 5 pages, 3 eps figure

Metallic ferromagnetism without exchange splitting

In the band theory of ferromagnetism there is a relative shift in the position of majority and minority spin bands due to the self-consistent field due to opposite spin electrons. In the simplest realization, the Stoner model, the majority and minority spin bands are rigidly shifted with respect to each other. Here we consider models at the opposite extreme, where there is no overall shift of the energy bands. Instead, upon spin polarization one of the bands broadens relative to the other. Ferromagnetism is driven by the resulting gain in kinetic energy. A signature of this class of mechanisms is that a transfer of spectral weight in optical absorption from high to low frequencies occurs upon spin polarization. We show that such models arise from generalized tight binding models that include off-diagonal matrix elements of the Coulomb interaction. For certain parameter ranges it is also found that reentrant ferromagnetism occurs. We examine properties of these models at zero and finite temperatures, and discuss their possible relevance to real materials

Rigorous results on superconducting ground states for attractive extended Hubbard models

We show that the exact ground state for a class of extended Hubbard models including bond-charge, exchange, and pair-hopping terms, is the Yang "eta-paired" state for any non-vanishing value of the pair-hopping amplitude, at least when the on-site Coulomb interaction is attractive enough and the remaining physical parameters satisfy a single constraint. The ground state is thus rigorously superconducting. Our result holds on a bipartite lattice in any dimension, at any band filling, and for arbitrary electron hopping.Comment: 12 page

Correlated hopping of electrons: Effect on the Brinkman-Rice transition and the stability of metallic ferromagnetism

We study the Hubbard model with bond-charge interaction (`correlated hopping') in terms of the Gutzwiller wave function. We show how to express the Gutzwiller expectation value of the bond-charge interaction in terms of the correlated momentum-space occupation. This relation is valid in all spatial dimensions. We find that in infinite dimensions, where the Gutzwiller approximation becomes exact, the bond-charge interaction lowers the critical Hubbard interaction for the Brinkman-Rice metal-insulator transition. The bond-charge interaction also favors ferromagnetic transitions, especially if the density of states is not symmetric and has a large spectral weight below the Fermi energy.Comment: 5 pages, 3 figures; minor changes, published versio

Possible isotope effect on the resonance peak formation in high-Tc_c cuprates

Starting from the three-band $p-d$ Hubbard Hamiltonian we derive an effective $t-J$ model including electron-phonon interaction of quasiparticles with optical phonons. Within the effective Hamiltonian we analyze the influence of electronic correlations and electron-phonon interaction on the dynamical spin susceptibility in layered cuprates. We find a huge isotope effect on the resonance peak in the magnetic spin susceptibility, ${Im}\chi({\bf q},\omega)$, seen by inelastic neutron scattering. It results from both the electron-phonon coupling and the electronic correlation effects taken into account beyond random phase approximation(RPA) scheme. We find at optimal doping the isotope coeffiecient $\alpha_{res} \approx 0.35$ which can be further tested experimentally.Comment: revised version, new figure is added. Phys. Rev. B 69, 0945XX (2004); in pres

Palaeobiology, ecology, and distribution of stromatoporoid faunas in biostromes of the mid-Ludlow of Gotland

Six well exposed mid−Ludlow stromatoporoid−dominated reef biostromes in four localities from the Hemse Group in southeastern Gotland, Sweden comprise a stromatoporoid assemblage dominated by four species; Clathrodictyon mohicanum, “Stromatopora” bekkeri, Plectostroma scaniense, and Lophiostroma schmidtii. All biostromes investigated in this area (of approximately 30 km2) are interpreted to belong to a single faunal assemblage forming a dense accumulation of fossils that is probably the best exposed stromatoporoid−rich deposit of the Silurian. The results from this comprehensive study strengthen earlier interpretations of a combination of genetic and environmental control on growth−forms of the stromatoporoids. Growth styles are similar for stromatoporoids in all six biostromes. Differences in biostrome fabric are due to variations in the degree of disturbance by storms. The uniformity of facies and the widespread low−diversity fauna support the view that palaeoenvironmental conditions were similar across the area where these biostromes crop out, and promoted the extraordinary growth of stromatoporoids in this shallow shelf area

Exact thermodynamics of an Extended Hubbard Model of single and paired carriers in competition

By exploiting the technique of Sutherland's species, introduced in \cite{DOMO-RC}, we derive the exact spectrum and partition function of a 1D extended Hubbard model. The model describes a competition between dynamics of single carriers and short-radius pairs, as a function of on-site Coulomb repulsion ($U$) and filling ($\rho$). We provide the temperature dependence of chemical potential, compressibility, local magnetic moment, and specific heat. In particular the latter turns out to exhibit two peaks, both related to `charge' degrees of freedom. Their origin and behavior are analyzed in terms of kinetic and potential energy, both across the metal-insulator transition point and in the strong coupling regime.Comment: 14 pages, 15 eps figure

Green function techniques in the treatment of quantum transport at the molecular scale

The theoretical investigation of charge (and spin) transport at nanometer length scales requires the use of advanced and powerful techniques able to deal with the dynamical properties of the relevant physical systems, to explicitly include out-of-equilibrium situations typical for electrical/heat transport as well as to take into account interaction effects in a systematic way. Equilibrium Green function techniques and their extension to non-equilibrium situations via the Keldysh formalism build one of the pillars of current state-of-the-art approaches to quantum transport which have been implemented in both model Hamiltonian formulations and first-principle methodologies. We offer a tutorial overview of the applications of Green functions to deal with some fundamental aspects of charge transport at the nanoscale, mainly focusing on applications to model Hamiltonian formulations.Comment: Tutorial review, LaTeX, 129 pages, 41 figures, 300 references, submitted to Springer series "Lecture Notes in Physics