Classification of the line-soliton solutions of KPII

In the previous papers (notably, Y. Kodama, J. Phys. A 37, 11169-11190 (2004), and G. Biondini and S. Chakravarty, J. Math. Phys. 47 033514 (2006)), we found a large variety of line-soliton solutions of the Kadomtsev-Petviashvili II (KPII) equation. The line-soliton solutions are solitary waves which decay exponentially in $(x,y)$-plane except along certain rays. In this paper, we show that those solutions are classified by asymptotic information of the solution as $|y| \to \infty$. Our study then unravels some interesting relations between the line-soliton classification scheme and classical results in the theory of permutations.Comment: 30 page

Semiempirical Hartree-Fock calculations for KNbO3

In applying the semiempirical intermediate neglect of differential overlap (INDO) method based on the Hartree-Fock formalism to a cubic perovskite-based ferroelectric material KNbO3, it was demonstrated that the accuracy of the method is sufficient for adequately describing the small energy differences related to the ferroelectric instability. The choice of INDO parameters has been done for a system containing Nb. Based on the parametrization proposed, the electronic structure, equilibrium ground state structure of the orthorhombic and rhombohedral phases, and Gamma-TO phonon frequencies in cubic and rhombohedral phases of KNbO3 were calculated and found to be in good agreement with the experimental data and with the first-principles calculations available.Comment: 7 pages, 2 Postscript figures, uses psfig.tex. To be published in Phys.Rev.B 54, No.4 (1996

KP solitons in shallow water

The main purpose of the paper is to provide a survey of our recent studies on soliton solutions of the Kadomtsev-Petviashvili (KP) equation. The classification is based on the far-field patterns of the solutions which consist of a finite number of line-solitons. Each soliton solution is then defined by a point of the totally non-negative Grassmann variety which can be parametrized by a unique derangement of the symmetric group of permutations. Our study also includes certain numerical stability problems of those soliton solutions. Numerical simulations of the initial value problems indicate that certain class of initial waves asymptotically approach to these exact solutions of the KP equation. We then discuss an application of our theory to the Mach reflection problem in shallow water. This problem describes the resonant interaction of solitary waves appearing in the reflection of an obliquely incident wave onto a vertical wall, and it predicts an extra-ordinary four-fold amplification of the wave at the wall. There are several numerical studies confirming the prediction, but all indicate disagreements with the KP theory. Contrary to those previous numerical studies, we find that the KP theory actually provides an excellent model to describe the Mach reflection phenomena when the higher order corrections are included to the quasi-two dimensional approximation. We also present laboratory experiments of the Mach reflection recently carried out by Yeh and his colleagues, and show how precisely the KP theory predicts this wave behavior.Comment: 50 pages, 25 figure

Applications of the generalized gradient approximation to ferroelectric perovskites

The Perdew-Burke-Ernzerhof generalized gradient approximation to the density functional theory is tested with respect to sensitivity to the choice of the value of the parameter $\kappa$, which is associated to the degree of localization of the exchange-correlation hole. A study of structural and dynamical properties of four selected ferroelectric perovskites is presented. The originally proposed value of $\kappa$=0.804 %(best suited for atoms and molecules) works well for some solids, whereas for the ABO$_3$ perovskites it must be decreased in order to predict equilibrium lattice parameters in good agreement with experiments. The effects on the structural instabilities and zone center phonon modes are examined. The need of varying $\kappa$ from one system to another reflects the fact that the localization of the exchange-correlation hole is system dependent, and the sensitivity of the structural properties to its actual value illustrates the necessity of finding a universal function for $\kappa$.Comment: 15 pages, 2 figures, PRB in pres

On scaling fields in ZNZ_N Ising models

We study the space of scaling fields in the $Z_N$ symmetric models with the factorized scattering and propose simplest algebraic relations between form factors induced by the action of deformed parafermionic currents. The construction gives a new free field representation for form factors of perturbed Virasoro algebra primary fields, which are parafermionic algebra descendants. We find exact vacuum expectation values of physically important fields and study correlation functions of order and disorder fields in the form factor and CFT perturbation approaches.Comment: 2 Figures, jetpl.cl

Electronic structure of Co_xTiSe_2 and Cr_xTiSe_2

The results of investigations of intercalated compounds Cr_xTiSe_2 and Co_xTiSe_2 by X-ray photoelectron spectroscopy (XPS) and X-ray emission spectroscopy (XES) are presented. The data obtained are compared with theoretical results of spin-polarized band structure calculations. A good agreement between theoretical and experimental data for the electronic structure of the investigated materials has been observed. The interplay between the M3d--Ti3d hybridization (M=Cr, Co) and the magnetic moment at the M site is discussed. A 0.9 eV large splitting of the core Cr2p{3/2} level was observed, which reveals a strong exchange magnetic interaction of 3d-2p electrons of Cr. In the case of a strong localization of the Cr3d electrons (for x<0.25), the broadening of the CrL spectra into the region of the states above the nominal Fermi level was observed and attributed to X-ray re-emission. The measured kinetic properties are in good accordance with spectral investigations and band calculation results.Comment: 14 pages, 11 figures, submitted to Phys.Rev.

ELECTRONIC STRUCTURE OF FeSi

The full set of high-energy spectroscopy measurements including X-ray photoelectron valence band spectra and soft X-ray emission valence band spectra of both components of FeSi (Fe K_beta_5, Fe L_alpha, Si K_beta_1,3 and Si L_2,3) are performed and compared with the results of ab-initio band structure calculations using the linearized muffin-tin orbital method and linearized augmented plane wave method.Comment: 11 pages + 3 PostScript figures, RevTex3.0, to be published in J.Phys.:Cond.Matte

Preparation and X-ray structure of 2-iodoxybenzenesulfonic acid (IBS) - a powerful hypervalent iodine(V) oxidant

The selective preparation of 2-iodoxybenzenesulfonic acid (IBS, as potassium or sodium salts) by oxidation of sodium 2-iodobenzenesulfonate with Oxone or sodium periodate in water is reported. The single crystal X-ray diffraction analysis reveals a complex polymeric structure consisting of three units of IBS as potassium salt and one unit of 2-iodoxybenzenesulfonic acid linked together by relatively strong I=O···I intermolecular interactions. Furthermore, a new method for the preparation of the reduced form of IBS, 2-iodosylbenzenesulfonic acid, by using periodic acid as an oxidant, has been developed. It has been demonstrated that the oxidation of free 2-iodobenzenesulfonic acid under acidic conditions affords an iodine(III) heterocycle (2-iodosylbenzenesulfonic acid), while the oxidation of sodium 2-iodobenzenesulfonate in neutral aqueous solution gives the iodine(V) products

Intersections of quadrics, moment-angle manifolds, and Hamiltonian-minimal Lagrangian embeddings

We study the topology of Hamiltonian-minimal Lagrangian submanifolds N in C^m constructed from intersections of real quadrics in a work of the first author. This construction is linked via an embedding criterion to the well-known Delzant construction of Hamiltonian toric manifolds. We establish the following topological properties of N: every N embeds as a submanifold in the corresponding moment-angle manifold Z, and every N is the total space of two different fibrations, one over the torus T^{m-n} with fibre a real moment-angle manifold R, and another over a quotient of R by a finite group with fibre a torus. These properties are used to produce new examples of Hamiltonian-minimal Lagrangian submanifolds with quite complicated topology.Comment: 14 pages, published version (minor changes