Accurate summation of the perturbation series for periodic eigenvalue problems

We show that algebraic approximants prove suitable for the summation of the perturbation series for the eigenvalues of periodic problems. Appropriate algebraic approximants constructed from the perturbation series for a given eigenvalue provide information about other eigenvalues connected with the chosen one by branch points in the complex plane. Such approximants also give those branch points with remarkable accuracy. We choose Mathieu's equation as illustrative example. Received 6 December 2000     

Padé approximants and the effective interaction

Analytic properties of the effective interaction allow us to indicate the positions of the poles of low-order Padé approximants and the domain of convergence of the series of Padé approximants. All evidence favors the conjecture that the Padé approximants will converge to that branch of the effective interaction which reproduces the model space states, if the series converges.     

Perturbation theory and Padé approximants in realistic large-matrix models of the nuclear effective interaction

Realistic extended shell-model calculations are used to construct exact effective Hamiltonians, the perturbation series for the effective Hamiltonian to any order, and the [N+1, N] Padé approximants to the series. It is found that the Padé approximants give reliable results even when the series diverge, but that for both convergent and divergent series reasonably accurate results can be obtained only in fifth, or even seventh order. In addition, the poles of the low-order Padé approximants are not always reliable indicators of singularities of the perturbation series. The perturbation series and Padé approximants for the Q-box (energy-dependent effective Hamiltonian) are no more accurate in low orders than those for the usual effective Hamiltonian. Explicit formulas for the matrix Padé approximants are given in an appendix.     

Use of Padé approximants in the evaluation of α and δ for one-dimensional maps

Recently an analytic algorithm for evaluating the Feigenbaum indices of one-dimensional maps was developed using a perturbative expansion. We find that the use of Padé approximants in the resulting asymptotic series, significantly improves the technique.     

Intermediate stages of a transformation between a quasicrystal and an approximant including nanodomain structures in the Al-Ni-Co system

Transition states between decagonal quasicrystal and periodic approximants are studied in the Al-Ni-Co system at a measured composition of Al_71.3Ni_11.3Co _17.4 by high-resolution transmission electron microscopy and electron diffraction. The nanodomain structures appearing after annealing at 1270 K show periodic fluctuations coherently embedded in domains with the coarse order of a one-dimensional quasicrystal. Further annealing at lower temperatures changes the features of nanodomain structures and results in an increase in more periodic structures. These can be strongly disordered and full of defects but tiling analysis and electron diffraction patterns show that they correspond to locked phason strain values of two closely related periodic approximants. We conclude that the periodic approximants do not result from a continuous increase in phason strain but from the growth of seeds with a locked phason strain.     

Numerical calculation of domains of analyticity for perturbation theories in the presence of small divisors

We study numerically the complex domains of validity for KAM theory in generalized standard mappings. We compare methods based on Padé approximants and methods based on the study of periodic orbits.     

Properties of Padé approximants to the effective interaction

Some properties of Padé approximants to effective interactions in nuclei are investigated. The behaviour of higher order approximants is discussed in model calculations. In the case of [2, l]-approximants a criterion is derived for the occurrence of spurious poles which are not related to level crossings.     

On the three-particle structure function of bose fluids

We derive an approximate expression for the three-particle structure function of a Bose fluid in its ground state. Specialization of our result regains the convolution approximation as well as the Berdahl-Family-Gould approximation. A discussion of the quality of these approximants is presented.Research supported by the Republican Council for Scientific Work of Bosnia and Herzegovina, Yugoslavia     

Effective conductivity for densely packed highly conducting cylinders

We study the effective heat conductivity λ₃ of a periodic square array of nearly touching cylinders of conductivity h, embedded in a matrix material of conductivity 1. We construct a sequence of two-point Padé approximants for the effective conductivity. As the basis for the construction we use the coefficients of the expansions of λ_e at h=1 and h=∞. The two-point Padé approximants form a sequence of rapidly converging upper and lower bounds on the effective conductivity.     

Method of self-similar factor approximants

The method of self-similar factor approximants is completed by defining the approximants of odd orders, constructed from the power series with the largest term of an odd power. It is shown that the method provides good approximations for transcendental functions. In some cases, just a few terms in a power series make it possible to reconstruct a transcendental function exactly. Numerical convergence of the factor approximants is checked for several examples. A special attention is paid to the possibility of extrapolating the behavior of functions, with arguments tending to infinity, from the related asymptotic series at small arguments. Applications of the method are thoroughly illustrated by the examples of several functions, nonlinear differential equations, and anharmonic models.     

Coulomb Scattering in the Massless Nelson Model I. Foundations of Two-Electron Scattering

We construct two-electron scattering states and verify their tensor product structure in the infrared-regular massless Nelson model. The proof follows the lines of Haag-Ruelle scattering theory: Scattering state approximants are defined with the help of two time-dependent renormalized creation operators of the electrons acting on the vacuum. They depend on the ground state wave functions of the (single-electron) fiber Hamiltonians with infrared cut-off. The convergence of these approximants as t→∞ is shown with the help of Cook’s method combined with a non-stationary phase argument. The removal of the infrared cut-off in the limit t→∞ requires sharp estimates on the derivatives of these ground state wave functions w.r.t. electron and photon momenta, with mild dependence on the infrared cut-off. These key estimates, which carry information about the localization of the electrons in space, are obtained in a companion paper with the help of iterative analytic perturbation theory. Our results hold in the weak coupling regime.     

Phonon-spectrum of an F-type icosahedral quasicrystal

We present calculations for the vibrational properties of F-type icosahedral quasicrystals. Two different approaches are compared, a cluster with complete icosahedral symmetry, and periodic approximants. Though no gaps in the spectra are observed, the well-known rescaling symmetry of ID systems is rediscovered in a generalized way.     

Continuum Limit of Susceptibility from Strong Coupling Expansion

On the basis of a strong-coupling expansion, we reinvestigate the scaling behavior of the susceptibility ?? of the two-dimensional O(N) sigma model on the square lattice with Padé?CBorel approximants. To exploit the Borel transform, we express the bare coupling g in a series expansion in ??. For large N, the Padé?CBorel approximants exhibit scaling behavior at the four-loop level. We estimate the nonperturbative constant associated with the susceptibility for N????3 and compare the results with previous analytica l results and Monte Carlo data.     

Crystal chemistry and chemical order in ternary quasicrystals and approximants

In this work we review our current understanding of structure, stability and formation of icosahedral quasicrystals and approximants. The work has special emphasis on Cd–Yb type phases, but several concepts are generalized to other families of icosahedral quasicrystals and approximants. The paper handles topics such as chemical order and site preference at the cluster level for ternary phases, valence electron concentration and its influence on formation and composition, fundamental building blocks and cluster linkages, and the similarities and differences between different families of icosahedral quasicrystals and approximants.     

Calculation of critical exponents by self-similar factor approximants

The method of self-similar factor approximants is applied to calculating the critical exponents of the O(N)-symmetric ϕ⁴ theory and of the Ising glass. It is demonstrated that this method, being much simpler than other known techniques of series summation in calculating the critical exponents, at the same time, yields the results that are in very good agreement with those of other rather complicated numerical methods. The principal advantage of the method of self-similar factor approximants is the combination of its extraordinary simplicity and high accuracy.     

First-principles prediction of a decagonal quasicrystal containing boron

We interpret experimentally known B-Mg-Ru crystals as quasicrystal approximants whose deterministic decoration of tiles by atoms can be extended quasiperiodically. Experimentally observed disorder corresponds to phason fluctuations. First-principles total energy calculations find many distinct tilings close to stability and suggest a phase transition from a crystalline state at low temperatures to a high temperature state characterized by tile fluctuations. We predict B38Mg17Ru45 forms a metastable decagonal quasicrystal that may be thermodynamically stable at high temperatures.     

Universal scaling of the conductivity at the superfluid-insulator phase transition

The scaling of the conductivity at the superfluid-insulator quantum phase transition in two dimensions is studied by numerical simulations of the Bose-Hubbard model. In contrast to previous studies, we focus on properties of this model in the experimentally relevant thermodynamic limit at finite temperature T. We find clear evidence for deviations from omega k scaling of the conductivity towards omega k/T scaling at low Matsubara frequencies omega k. By careful analytic continuation using Padé approximants we show that this behavior carries over to the real frequency axis where the conductivity scales with omega/T at small frequencies and low temperatures. We estimate the universal dc conductivity to be sigma* = 0.45(5)Q2/h, distinct from previous estimates in the T = 0, omega/T > 1 limit.     

Three-dimensional photonic quasicrystal with a complete band gap

The band structure of three-dimensional cubic approximants of a photonic quasicrystal has been determined by numerical calculation. The approximants of different orders appear to have large, almost isotropic, band gaps in a wide range of relative permittivity values. The existence of the complete band gap in the photonic quasicrystal with the six-dimensional bcc lattice is shown.     

Complex modes and instability of full-vectorial beam propagation methods

Full-vectorial beam propagation methods (FVBPMs) are widely used to model light waves propagating in high-index-contrast optical waveguides. We show that the paraxial FVBPM and wide-angle FVBPMs based on diagonal Padé approximants are analytically unstable for waveguides with complex modes. The instability cannot be removed by enlarging the computational domain, increasing the numerical resolution, or using perfectly matched layers, because the complex modes are highly confined around the waveguide core.