Neel order, ring exchange and charge fluctuations in the half-filled Hubbard model

We investigate the ground state properties of the two dimensional half-filled one band Hubbard model in the strong (large-U) to intermediate coupling limit ({\it i.e.} away from the strict Heisenberg limit) using an effective spin-only low-energy theory that includes nearest-neighbor exchange, ring exchange, and all other spin interactions to order t(t/U)^3. We show that the operator for the staggered magnetization, transformed for use in the effective theory, differs from that for the order parameter of the spin model by a renormalization factor accounting for the increased charge fluctuations as t/U is increased from the t/U -> 0 Heisenberg limit. These charge fluctuations lead to an increase of the quantum fluctuations over and above those for an S=1/2 antiferromagnet. The renormalization factor ensures that the zero temperature staggered moment for the Hubbard model is a monotonously decreasing function of t/U, despite the fact that the moment of the spin Hamiltonien, which depends on transverse spin fluctuations only, in an increasing function of t/U. We also comment on quantitative aspects of the t/U and 1/S expansions.Comment: 9 pages - 3 figures - References and details to help the reader adde

Ferroelectric and Dipolar Glass Phases of Non-Crystalline Systems

In a recent letter [Phys. Rev. Lett. {\bf 75}, 2360 (1996)] we briefly discussed the existence and nature of ferroelectric order in positionally disordered dipolar materials. Here we report further results and give a complete description of our work. Simulations of randomly frozen and dynamically disordered dipolar soft spheres are used to study ferroelectric ordering in non-crystalline systems. We also give a physical interpretation of the simulation results in terms of short- and long-range interactions. Cases where the dipole moment has 1, 2, and 3 components (Ising, XY and XYZ models, respectively) are considered. It is found that the Ising model displays ferroelectric phases in frozen amorphous systems, while the XY and XYZ models form dipolar glass phases at low temperatures. In the dynamically disordered model the equations of motion are decoupled such that particle translation is completely independent of the dipolar forces. These systems spontaneously develop long-range ferroelectric order at nonzero temperature despite the absence of any fined-tuned short-range spatial correlations favoring dipolar order. Furthermore, since this is a nonequilibrium model we find that the paraelectric to ferroelectric transition depends on the particle mass. For the XY and XYZ models, the critical temperatures extrapolate to zero as the mass of the particle becomes infinite, whereas, for the Ising model the critical temperature is almost independent of mass and coincides with the ferroelectric transition found for the randomly frozen system at the same density. Thus in the infinite mass limit the results of the frozen amorphous systems are recovered.Comment: 25 pages (LATEX, no macros). 11 POSTSCRIPT figures enclosed. Submitted to Phisical Review E. Contact: [email protected]

The Spin Liquid State of the Tb2Ti2O7 Pyrochlore Antiferromagnet: A Puzzling State of Affairs

The pyrochlore antiferromagnet Tb2Ti2O7 has proven to be an enigma to experimentalists and theorists working on frustrated magnetic systems. The experimentally determined energy level structure suggests a local Ising antiferromagnet at low temperatures, T < 10 K. An appropriate model then predicts a long-range ordered Q = 0 state below approximately 2 K. However, muon spin resonance experiments reveal a paramagnetic structure down to tens of milli-Kelvin. The importance of fluctuations out of the ground state effective Ising doublet has been recently understood, for the measured paramagnetic correlations can not be described without including the higher crystal field states. However, these fluctuations treated within the random phase approximation (RPA) fail to account for the lack of ordering in this system below 2 K. In this work, we briefly review the experimental evidence for the collective paramagnetic state of Tb2Ti2O7. The basic theoretical picture for this system is discussed, where results from classical spin models are used to motivate the investigation of quantum effects to lowest order via the RPA. Avenues for future experimental and theoretical work on Tb2Ti2O7 are presented.Comment: Latex2e,6 pages, IOP format, introduction shortened and other minor corrections, replaced with published version in the Proceedings of the Highly Frustrated Magnetism 2003 Conference, Grenobl

Quantum spin fluctuations in the dipolar Heisenberg-like rare earth pyrochlores

The magnetic pyrochlore oxide materials of general chemical formula R2Ti2O7 and R2Sn2O7 (R = rare earth) display a host of interesting physical behaviours depending on the flavour of rare earth ion. These properties depend on the value of the total magnetic moment, the crystal field interactions at each rare earth site and the complex interplay between magnetic exchange and long-range dipole-dipole interactions. This work focuses on the low temperature physics of the dipolar isotropic frustrated antiferromagnetic pyrochlore materials. Candidate magnetic ground states are numerically determined at zero temperature and the role of quantum spin fluctuations around these states are studied using a Holstein-Primakoff spin wave expansion to order 1/S. The results indicate the strong stability of the proposed classical ground states against quantum fluctuations. The inclusion of long range dipole interactions causes a restoration of symmetry and a suppression of the observed anisotropy gap leading to an increase in quantum fluctuations in the ground state when compared to a model with truncated dipole interactions. The system retains most of its classical character and there is little deviation from the fully ordered moment at zero temperature.Comment: Latex2e, 18 pages, 4 figures, IOP forma

Glassiness Vs. Order in Densely Frustrated Josephson Arrays

We carry out extensive Monte Carlo simulations on the Coulomb gas dual to the uniformly frustrated two dimensional XY model, for a sequence of frustrations f converging to the irraltional (3-sqrt 5)/2. We find in these systems a sharp first order equilibrium phase transition to an ordered vortex structure at a T_c which varies only slightly with f. This ordered vortex structure remains in general phase incoherent until a lower pinning transition T_p(f) that varies with f. We argue that the glassy behaviors reported for this model in earlier simulations are dynamic effects.Comment: 4 pages, 4 eps figure

The crystal structure of Pneumolysin at 2.0 Å resolution reveals the molecular packing of the pre-pore complex

Pneumolysin is a cholesterol-dependent cytolysin (CDC) and virulence factor of Streptococcus pneumoniae. It kills cells by forming pores assembled from oligomeric rings in cholesterol-containing membranes. Cryo-EM has revealed the structures of the membrane-surface bound pre-pore and inserted-pore oligomers, however the molecular contacts that mediate these oligomers are unknown because high-resolution information is not available. Here we have determined the crystal structure of full-length pneumolysin at 1.98 Å resolution. In the structure, crystal contacts demonstrate the likely interactions that enable polymerisation on the cell membrane and the molecular packing of the pre-pore complex. The hemolytic activity is abrogated in mutants that disrupt these intermolecular contacts, highlighting their importance during pore formation. An additional crystal structure of the membrane-binding domain alone suggests that changes in the conformation of a tryptophan rich-loop at the base of the toxin promote monomer-monomer interactions upon membrane binding by creating new contacts. Notably, residues at the interface are conserved in other members of the CDC family, suggesting a common mechanism for pore and pre-pore assembly

Evaluation of mTOR-regulated mRNA translation.

mTOR, the mammalian target of rapamycin, regulates protein synthesis (mRNA translation) by affecting the phosphorylation or activity of several translation factors. Here, we describe methods for studying the impact of mTOR signalling on protein synthesis, using inhibitors of mTOR such as rapamycin (which impairs some of its functions) or mTOR kinase inhibitors (which probably block all functions).To assess effects of mTOR inhibition on general protein synthesis in cells, the incorporation of radiolabelled amino acids into protein is measured. This does not yield information on the effects of mTOR on the synthesis of specific proteins. To do this, two methods are described. In one, stable-isotope labelled amino acids are used, and their incorporation into new proteins is determined using mass spectrometric methods. The proportions of labelled vs. unlabeled versions of each peptide from a given protein provide quantitative information about the rate of that protein's synthesis under different conditions. Actively translated mRNAs are associated with ribosomes in polyribosomes (polysomes); thus, examining which mRNAs are found in polysomes under different conditions provides information on the translation of specific mRNAs under different conditions. A method for the separation of polysomes from non-polysomal mRNAs is describe

Filling-induced Mott transition and pseudogap physics in the triangular lattice Hubbard model

It has been reported that upon doping a Mott insulator, there can be a crossover to a strongly correlated metallic phase followed by a first-order transition to another thermodynamically stable metallic phase. We call this first-order metal-metal transition the Sordi transition. To show theoretically that this transition is observable, it is important to provide calculations in situations where magnetic phase transitions do not hide the Sordi transition. It is also important to show that it can be found on large clusters and with different approaches. Here, we use the dynamical cluster approximation to reveal the Sordi transition on a triangular lattice at finite temperature in situations where there is no long-range magnetic correlations. This is relevant for experiments on candidate spin-liquid organics. We also show that the metallic phase closest to the insulator is a distinct pseudogap phase that occurs because of strong interactions and short-range correlations

On the theory of diamagnetism in granular superconductors

We study a highly disordered network of superconducting granules linked by weak Josephson junctions in magnetic field and develop a mean field theory for this problem. The diamagnetic response to a slow {\it variations} of magnetic field is found to be analogous to the response of a type-II superconductor with extremely strong pinning. We calculate an effective penetration depth $\lambda_g$ and critical current $j_c$ and find that both $\lambda_g^{-1}$ and $j_c$ are non-zero but are strongly suppressed by frustration.Comment: REVTEX, 12 pages, two Postscript figure