Convection in a gravitational field

We set up a classical stochastic model for the irreversible dynamics of a lattice gas under gravity. We show that for a class of initial states the system converges to equilibrium, which obeys the laws of thermostatics.Dedicated to Oliver Penrose.     

三螺旋核酸polyU·polyA·polyU的喇曼光谱和晶格动力学研究

由于三螺旋核酸在医疗、诊断和生物技术应用中的重要性,越来越受到人们的关注.对溶于0.25mol/L的NaCl磷酸缓冲液的三螺旋核酸polyU·polyA·polyU的喇曼光谱进行了测量,在750～1250cm^-1范围内获得了高信噪比的光谱图.利用晶格动力学方法计算了Anott模型的主链振动模式.根据势能分布矩阵对每一个喇曼谱线进行了指定.结果表明polyU·polyA·polyU的三条单链具有相似的简正模式,没有一条喇曼线独属于某个单链.理论同实验符合的事实说明溶液中的polyU·polyA·polyU采用了A型结构.     

Structure,analysis and some magnetic properties for low temperature fired Ni–Cu ferrite

Cu²⁺ ions substituted Ni-ferrite having the general formula Ni_1-xCu_xFe₂O₄ (where x=0.0, 0.2, 0.4 and 0.6) were prepared by the sintering ceramic method. X-ray diffraction, infrared spectra and magnetization of the above ferrite were carried out to investigate structural and magnetic characterization of this ferrite. Crystallite size, lattice parameters, positional oxygen parameter and ionic radii for both tetrahedral and octahedral sites were calculated. The experimental lattice parameter was found to vary between 8.3856 and 8.3865 Å. The infrared spectra were measured in the frequency range 650–150 cm⁻¹. Two prominent bands were observed, high frequency band ν₁ and low frequency band ν₂ were assigned to tetrahedral and octahedral sites. Bond length and force constant were also calculated for both tetrahedral and octahedral sites. The effect of Cu concentration on, saturation magnetization, coercivity ratio and magnetic moment were investigated using vibrating sample magnetometer (VSM). It was found that both saturation magnetization (M_S) and coercivity (H_c) decreases with increasing in Cu content.     

Liouville Integrable System and Associated Integrable Coupling

Liouville integrable discrete integrable system is derived based on discrete isospectral problem. It is shown that the hierarchy is completely integrable in the Liouville sense and possesses bi-Hamiltonian structure. Finally, integrable couplings of the obtained system is given by means of semi-direct sums of Lie algebras.     

Molecular dynamics simulations of structural disordering and forming defects in a milling process for selenium

In our previous paper, structural changes of selenium powders ground by a planetary ball mill at various rotational speeds were investigated for the nanostructural modification of particles using mechanical grinding process. The experimental results indicated that the amorphisation of Se by grinding accompanies lattice strain, and the lattice strain arises from impact energy which is more than an energy related to intermolecular interaction. In this paper, molecular dynamics simulations of selenium have been carried out under compressing conditions of various pressure strengths for obtaining information of the lattice strain at atomic level. Then, dynamical behaviour of atomic configuration has been discussed in this process. The structural disordering and formation of the structural defects were estimated by deviations of bond length and angle and the number of created defects before and after compressing from simulated results. The disordering took place during compressing at various pressure strengths, and the disordered atoms return to their initial positions at lower pressure. Stable disordered state and defects after the compression can however remain by compression at more than a certain pressure strength mainly associated with binding energy of selenium.     

Scaling of particle trajectories on a lattice

The scaling behavior of the closed trajectories of a moving particle generated by randomly placed rotators or mirrors on a square or triangular lattice is studied numerically. On both lattices, for most concentrations of the scatterers the trajectories close exponentially fast. For special critical concentrations infinitely extended trajectories can occur which exhibit a scaling behavior similar to that of the perimeters of percolation clusters.At criticality, in addition to the two critical exponents =15/7 andd _f=7/4 found before, the critical exponent =3/7 appears. This exponent determines structural scaling properties of closed trajectories of finite size when they approach infinity. New scaling behavior was found for the square lattice partially occupied by rotators, indicating a different universality class than that of percolation clusters.Near criticality, in the critical region, two scaling functions were determined numerically:f(x), related to the trajectory length (S) distributionn _s, andh(x), related to the trajectory sizeR _s (gyration radius) distribution, respectively. The scaling functionf(x) is in most cases found to be a symmetric double Gaussian with the same characteristic size exponent =0.433/7 as at criticality, leading to a stretched exponential dependence ofn _S onS, n_Sexp(–S ^6/7). However, for the rotator model on the partially occupied square lattice an alternative scaling function is found, leading to a new exponent =1.6±0.3 and a superexponential dependence ofn _S onS.h(x) is essentially a constant, which depends on the type of lattice and the concentration of the scatterers. The appearance of the same exponent =3/7 at and near a critical point is discussed.     

The algebraic Bethe ansatz for rational braid-monoid lattice models

In this paper we study isotropic integrable systems based on the braid-monoid algebra. These systems constitute a large family of rational multistate vertex models and are realized in terms of the B_n, C_nand D_n Lie algebra and by the superalgebra Osp(n||2m). We present a unified formulation of the quantum inverse scattering method for many of these lattice models. The appropriate fundamental commutation rules are found, allowing us to construct the eigenvectors and the eigenvaluesof the transfer matrix associated to the B_n, C_n, D_n, Osp(2nt-1||2), Osp(2||2nt-2), Osp(2nt-2||2) and Osp(1||2n) models. The corresponding Bethe ansatz equations can be formulated in terms of the root structure of the underlying algebra.     

SCDA for 3D lattice gases with repulsive interaction

The selfconsistent diagram approximation (SCDA) is generalized for three-dimensional lattice gases with nearest neighbor repulsive interactions. The free energy is represented in a closed form through elementary functions. Thermodynamical (phase diagrams, chemical potential and mean square fluctuations), structural (order parameter, distribution functions) as well as diffusional characteristics are investigated. The calculation results are compared with the Monte Carlo simulation data to demonstrate high precision of the SCDA in reproducing the equilibrium lattice gas characteristics. It is shown that similarly to two-dimensional systems the specific statistical memory effects strongly influence the lattice gas diffusion in the ordered states. Received 7 August 2002 / Received in final form 22 January 2003 Published online 24 April 2003     

Nature of the Peierls- to Mott-insulator transition in 1D

In order to clarify the physics of the crossover from a Peierls band insulator to a correlated Mott-Hubbard insulator, we analyze ground-state and spectral properties of the one-dimensional half-filled Holstein-Hubbard model using quasi-exact numerical techniques. In the adiabatic limit the transition is connected to the band to Mott insulator transition of the ionic Hubbard model. Depending on the strengths of the electron-phonon coupling and the Hubbard interaction the transition is either first order or evolves continuously across a narrow intermediate phase with finite spin, charge, and optical excitation gaps. Received 7 July 2002 / Received in final form 21 October 2002 Published online 27 January 2003 RID="a" ID="a"e-mail: holger.fehske@physik.uni-greifswald.de     

Persistent currents in a lattice correlated electron ring with a magnetic impurity

The behavior of charge and spin persistent currents in an integrable lattice ring of strongly correlated electrons with a magnetic impurity is exactly studied. Our results manifest that the oscillations of charge and spin persistent currents are similar to the ones, earlier obtained for integrable continuum models with a magnetic impurity. The difference is due to two (instead of one) Fermi velocities of low-lying excitations. The form of oscillations in the ground state is “saw-tooth”-like, generic for any multi-particle coherent one-dimensional models. The integrable magnetic impurity introduces net charge and spin chiralities in the generic integrable lattice system, which determine the initial phase shifts of charge and spin persistent currents. We show that the magnitude of the charge persistent current in the generic Kondo situation does not depend on the parameters of the magnetic impurity, unlike the (magneto)resistivity of transport currents. Received 30 January 2003 / Received in final form 12 March 2003 Published online 11 April 2003 RID="a" ID="a"e-mail: zvyagin@fy.chalmers.se