The s=1/2s=1/2 Antiferromagnetic Heisenberg Model on Fullerene-Type Symmetry Clusters

The $s_{i}={1/2}$ nearest neighbor antiferromagnetic Heisenberg model is considered for spins sitting on the vertices of clusters with the connectivity of fullerene molecules and a number of sites $n$ ranging from 24 to 32. Using the permutational and spin inversion symmetries of the Hamiltonian the low energy spectrum is calculated for all the irreducible representations of the symmetry group of each cluster. Frustration and connectivity result in non-trivial low energy properties, with the lowest excited states being singlets except for $n=28$. Same hexagon and same pentagon correlations are the most effective in the minimization of the energy, with the $n=32-D_{3h}$ symmetry cluster having an unusually strong singlet intra-pentagon correlation. The magnetization in a field shows no discontinuities unlike the icosahedral $I_h$ fullerene clusters, but only plateaux with the most pronounced for $n=28$. The spatial symmetry as well as the connectivity of the clusters appear to be important for the determination of their magnetic properties.Comment: Extended to include low energy spectra, correlation functions and magnetization data of clusters up to 32 site

Group projector generalization of dirac-heisenberg model

The general form of the operators commuting with the ground representation (appearing in many physical problems within single particle approximation) of the group is found. With help of the modified group projector technique, this result is applied to the system of identical particles with spin independent interaction, to derive the Dirac-Heisenberg hamiltonian and its effective space for arbitrary orbital occupation numbers and arbitrary spin. This gives transparent insight into the physical contents of this hamiltonian, showing that formal generalizations with spin greater than 1/2 involve nontrivial additional physical assumptions.Comment: 10 page

Nonlinear Band Structure in Bose Einstein Condensates: The Nonlinear Schr\"odinger Equation with a Kronig-Penney Potential

All Bloch states of the mean field of a Bose-Einstein condensate in the presence of a one dimensional lattice of impurities are presented in closed analytic form. The band structure is investigated by analyzing the stationary states of the nonlinear Schr\"odinger, or Gross-Pitaevskii, equation for both repulsive and attractive condensates. The appearance of swallowtails in the bands is examined and interpreted in terms of the condensates superfluid properties. The nonlinear stability properties of the Bloch states are described and the stable regions of the bands and swallowtails are mapped out. We find that the Kronig-Penney potential has the same properties as a sinusoidal potential; Bose-Einstein condensates are trapped in sinusoidal optical lattices. The Kronig-Penney potential has the advantage of being analytically tractable, unlike the sinusoidal potential, and, therefore, serves as a good model for experimental phenomena.Comment: Version 2. Fixed typos, added referenc

Affine T-varieties of complexity one and locally nilpotent derivations

Let X=spec A be a normal affine variety over an algebraically closed field k of characteristic 0 endowed with an effective action of a torus T of dimension n. Let also D be a homogeneous locally nilpotent derivation on the normal affine Z^n-graded domain A, so that D generates a k_+-action on X that is normalized by the T-action. We provide a complete classification of pairs (X,D) in two cases: for toric varieties (n=\dim X) and in the case where n=\dim X-1. This generalizes previously known results for surfaces due to Flenner and Zaidenberg. As an application we compute the homogeneous Makar-Limanov invariant of such varieties. In particular we exhibit a family of non-rational varieties with trivial Makar-Limanov invariant.Comment: 31 pages. Minor changes in the structure. Fixed some typo

Density Functional Theory for the Photoionization Dynamics of Uracil

Photoionization dynamics of the RNA base Uracil is studied in the framework of Density Functional Theory (DFT). The photoionization calculations take advantage of a newly developed parallel version of a multicentric approach to the calculation of the electronic continuum spectrum which uses a set of B-spline radial basis functions and a Kohn-Sham density functional hamiltonian. Both valence and core ionizations are considered. Scattering resonances in selected single-particle ionization channels are classified by the symmetry of the resonant state and the peak energy position in the photoelectron kinetic energy scale; the present results highlight once more the site specificity of core ionization processes. We further suggest that the resonant structures previously characterized in low-energy electron collision experiments are partly shifted below threshold by the photoionization processes. A critical evaluation of the theoretical results providing a guide for future experimental work on similar biosystems

Noise Can Reduce Disorder in Chaotic Dynamics

We evoke the idea of representation of the chaotic attractor by the set of unstable periodic orbits and disclose a novel noise-induced ordering phenomenon. For long unstable periodic orbits forming the strange attractor the weights (or natural measure) is generally highly inhomogeneous over the set, either diminishing or enhancing the contribution of these orbits into system dynamics. We show analytically and numerically a weak noise to reduce this inhomogeneity and, additionally to obvious perturbing impact, make a regularizing influence on the chaotic dynamics. This universal effect is rooted into the nature of deterministic chaos.Comment: 11 pages, 5 figure

Spin Polaron Effective Magnetic Model for La_{0.5}Ca_{0.5}MnO_3

The conventional paradigm of charge order for La_{1-x}Ca_xMnO_3 for x=0.5 has been challenged recently by a Zener polaron picture emerging from experiments and theoretical calculations. The effective low energy Hamiltonian for the magnetic degrees of freedom has been found to be a cubic Heisenberg model, with ferromagnetic nearest neighbor and frustrating antiferromagnetic next nearest neighbor interactions in the planes, and antiferromagnetic interaction between planes. With linear spin wave theory and diagonalization of small clusters up to 27 sites we find that the behavior of the model interpolates between the A and CE-type magnetic structures when a frustrating intraplanar interaction is tuned. The values of the interactions calculated by ab initio methods indicate a possible non-bipartite picture of polaron ordering differing from the conventional one.Comment: 21 pages and 8 figures (included), Late

Clebsch-Gordan Construction of Lattice Interpolating Fields for Excited Baryons

Large sets of baryon interpolating field operators are developed for use in lattice QCD studies of baryons with zero momentum. Operators are classified according to the double-valued irreducible representations of the octahedral group. At first, three-quark smeared, local operators are constructed for each isospin and strangeness and they are classified according to their symmetry with respect to exchange of Dirac indices. Nonlocal baryon operators are formulated in a second step as direct products of the spinor structures of smeared, local operators together with gauge-covariant lattice displacements of one or more of the smeared quark fields. Linear combinations of direct products of spinorial and spatial irreducible representations are then formed with appropriate Clebsch-Gordan coefficients of the octahedral group. The construction attempts to maintain maximal overlap with the continuum SU(2) group in order to provide a physically interpretable basis. Nonlocal operators provide direct couplings to states that have nonzero orbital angular momentum.Comment: This manuscript provides an anlytical construction of operators and is related to hep-lat/0506029, which provides a computational construction. This e-print version contains a full set of Clebsch-Gordan coefficients for the octahedral grou

Fitting Ranked English and Spanish Letter Frequency Distribution in U.S. and Mexican Presidential Speeches

The limited range in its abscissa of ranked letter frequency distributions causes multiple functions to fit the observed distribution reasonably well. In order to critically compare various functions, we apply the statistical model selections on ten functions, using the texts of U.S. and Mexican presidential speeches in the last 1-2 centuries. Dispite minor switching of ranking order of certain letters during the temporal evolution for both datasets, the letter usage is generally stable. The best fitting function, judged by either least-square-error or by AIC/BIC model selection, is the Cocho/Beta function. We also use a novel method to discover clusters of letters by their observed-over-expected frequency ratios.Comment: 7 figure

Numerically improved computational scheme for the optical conductivity tensor in layered systems

The contour integration technique applied to calculate the optical conductivity tensor at finite temperatures in the case of layered systems within the framework of the spin-polarized relativistic screened Korringa-Kohn-Rostoker band structure method is improved from the computational point of view by applying the Gauss-Konrod quadrature for the integrals along the different parts of the contour and by designing a cumulative special points scheme for two-dimensional Brillouin zone integrals corresponding to cubic systems.Comment: 17 pages, LaTeX + 4 figures (Encapsulated PostScript), submitted to J. Phys.: Condensed Matter (19 Sept. 2000