链间超交换相互作用下spin-Peierls梯子模型的基态行为

采用Lanczos数值计算方法研究了具有链间海森堡相互作用和链间Dzyaloshinskii-Moriya(DM)相互作用spin-Peierls梯子模型的基态行为.分析了链间海森堡相互作用和链间DM相互作用对系统二聚化的影响.结果发现，这两种链间作用都不利于系统的二聚化，会造成系统基态二聚化的减小，这说明随着系统维度的增大，系统的各向相互作用会限制系统的二聚化，甚至会破坏系统的二聚化相. 关键词： spin-Peierls模型 海森堡相互作用 DM相互作用 二聚化     

Low-frequency librational vibrations,boson peak,and interchain interactions in a vitreous polymer

The IR and Raman spectra of plasticized poly(methyl methacrylate) (PMMA) are measured and analyzed in the frequency range 10–120 cm^?1, in which the absorption and scattering due to the individual (85–90 cm^?1) and correlated librational vibrations (15–20 cm^?1, boson peak) preceding the appearance of relaxation dynamics manifest themselves. It is demonstrated that the presence of the boson peak as an indication of the solid-state behavior of the polymer material in the low-frequency spectra is associated with the correlation of librational vibrations not only inside macromolecules (in segments corresponding in length to the Kuhn segment) but also in segments of neighboring chains.     

Long-range interactions in polymer melts: the anti-Casimir effect

It is well known that small neutral particles normally tend to aggregate due to the van der Waals forces. We discover a new universal long-range interaction between solid objects in polymer media that is directly opposite the van der Waals attraction. The new force could reverse the sign of the net interaction, possibly leading to the net repulsion. This universal repulsion comes from the subtracted soft fluctuation modes, which are not present in the real polymer system, but rather are in its ideal counterpart. The predicted effect has a deep relation to the classical Casimir interactions, providing an unusual example of fluctuation-induced repulsion instead of normal attraction. That is why it is referred to as the anti-Casimir effect. We also find that the correlation function of monomer units in a concentrated solution of infinite polymer chains follows a power-law rather than an exponential decay at large distances.     

Electronic effect and elastic properties of RbH2PO4 crystals

We have studied the dielectric, elastic piezoelectric properties, and the electrocaloric effect of a single crystal of RbH₂PO₄. If RbDP undergoes a first order transition, the temperature range must be small and a small field can change it to a second order one.     

Measurement of interchain and intrachain exciton hopping barriers in luminescent polymer

The integrated photoluminescence intensity in thin films of 'Super Yellow' copolymer has been analyzed using a Mott-like temperature dependence. This has enabled us to observe contributions from two emission channels, indicative of exciton recombination proceeding from two distinct origins. At high temperature, interchain thermally activated exciton energy transfer and migration dominates, resulting in large scale quenching of the integrated emission intensity and hence the photoluminescence quantum yield. However, at relatively low temperature, an additional increase of the integrated emission intensity occurs. This new channel of emission has been attributed to recombination from excitons where intrachain exciton energy transfer between adjacent subunits of the copolymer backbone becomes hindered. The activation energy barriers that control both of these emission channels have been obtained and are correlated with chain backbone degrees of freedom.     

Computer simulation of structure and mechanical properties of polymer liquid crystals

In this contribution, we report on a study of the self-organization and mechanical properties of polymer liquid crystals (PLCs). Both processes are computer simulated by the method of molecular dynamics. We investigated two real longitudinal PLCs (thermotropic polyesters) with macromolecules that consist of rigid and flexible parts arranged in a regular way. One rigid and one flexible part form a monomer containing 45 or 47 atoms. The total number of atoms in the macromolecules studied was 4700 (100 monomers) and 5400 (75 monomers). The self-organization was similar to that obtained earlier for a beads-on-a-string model, so compression calculations were done using this simpler model containing 1200 beads (100 monomers). Macroscopic characteristics such as the stress-strain relation, temperature change during deformation, as well as microscopic changes in structure, were investigated.     

Electronic crystals: an experimental overview

This article reviews the static and dynamic properties of spontaneous superstructures formed by electrons. Representations of such electronic crystals are charge density waves (CDW) and spin density waves in inorganic as well as organic low-dimensional materials. A special attention is paid to the collective effects in pinning and sliding of these superstructures, and the glassy properties at low temperature. Charge order and charge disproportionation which occur in organic materials resulting from correlation effects are analysed. Experiments under magnetic field, and more specifically field-induced CDWs are discussed. Properties of meso- and nanostructures of CDWs are also reviewed.     

Anisotropy of interchain interaction in polymeric (SN)x crystals

The technique of polarized reflection microspectroscopy was used to study anisotropy of polymeric sulfur nitride (SN)_x in plasma edge region. The spectra taken from different faces of single crystals indicate the presence of strong anisotropy of interchain interaction due to orientation of the π-electron orbitals and suggest two-dimensional metallic behavior of the π-electron system in (SN)_x.     

Electronic properties of C60 single crystals doped with lithium by electrodiffusion

Diffusion of lithium cations in C₆₀ single crystals driven by electric field has been detected and studied. A novel technique for fullerene crystal doping based on injection of ions through a “superionic crystal/C₆₀ single crystal” heterojunction has been suggested. It has been found that lithium doping of C₆₀ single crystals brings about an ESR signal, and this signal as a function of time has been investigated. The electronic conductivity in Li_xC₆₀ crystals has a nonmetallic nature. Reflection spectra measured in the IR band have shown that the reflectivity due to free electrons gradually decreases with time, which correlates with the evolution of signals due to ESR and microwave conductivity. Lithium doping of crystals increases the oscillator strength of the T _1u (4) vibrational mode and shifts it to lower frequencies (from 1429 cm⁻¹ to 1413 cm⁻¹), which indicates that one electron is present at the C₆₀ molecule, and this fact may be treated as evidence that the LiC₆₀ phase is generated in a C₆₀ crystal. Zh. éksp. Teor. Fiz. 116, 1706–1722 (November 1999)     

Morphological instabilities of polymer crystals

We present experimental observations at comparatively low supercooling of morphology transitions from dendritic to faceted structures in polymer crystals growing in thin films of a poly-2-vinylpyridineblock-polyethyleneoxid copolymer. Our results are compared with theoretical concepts describing morphological instabilities of single crystals. Although these concepts originally were not developed for polymers, they allow to describe and interpret our experimental results quite well. In particular, the measured temperature dependence of the width W and frequency of dendritic side branches and the radius of curvature ρ of the growth tips of the crystals follow these concepts. We present preliminary evidence for the influence of polymer attachment kinetics and reorganisation processes behind the growth front. Polymer thin films provide valuable model systems for studying general concepts of crystallisation and allow to distinguish at which point the connectivity of the crystallising units within chain-like molecules starts to play a measurable role.     

Superprism properties in 2D polymer photonic crystals at high normal frequencies

The superprism effects of higher bands, i.e., for normal frequencies of higher than one, in two-dimensional (2D) polymer photonic crystals (PCs) are investigated. It is shown that in a polymer PC of triangular symmetry with filling factor of about 31%, the gradual transition of the hexagonal into triangular equi-frequency dispersion contours leads to a strong superprism in the 6th band at a normal frequency of 1.2. This dispersion is more prominent than those observed in the lower bands in 2D PCs. Also, this requires a lattice constant longer than the concerned wavelength. Furthermore, in a 2D polymer PC with a filling factor of about 83% a strong discontinuous superprism effect occurs at normal frequencies higher than one, which is due to an abrupt transition between two modes with the refraction angles of opposite signs. The effect can be exploited for switching applications as demonstrated in the paper.     

General properties of lasing effect in chiral liquid crystals

Numerical simulations and experimental studies of the lasing effect in chiral liquid crystals are presented. It is shown that ring-like light emission, which is often observed experimentally, is a true lasing effect. Lasing condition and different modes in thin liquid crystal layers are discussed.     

Electronic properties of Bi2Se3 crystals

Bismuth selenide crystals were grown from melts with liquid concentrations within 0·2 per cent of stoichiometry. The resulting crystals were examined structurally showing that single crystal samples could be cut for electronic property measurements. Samples were n-type and degenerate (n ～ 2 × 10²⁵ m^?3). Hall, magnetoresistance and Shubnikov-de Haas measurements confirm that the carriers lie in a single minimum located at the centre of the Brillouin Zone. The results are discussed in terms of a non-ellipsoidal band model, and the degeneracy discussed in terms of a defect model.     

Mechanical properties and photomechanical effect in GaP single crystals

Mechanical properdes of GaP single crystals have been investigated from 100° to 300°C by observing dislocation rosette patterns on indented specimen surfaces. It has been found that GaP has mechanical properties which are common to those of other III–V compounds or elemental semiconductors in several points: the {111} surface polarity dependence of microhardness, the mobility difference between α- and β-dislocations, and the conduction type dependence of dislocation mobility. The growth of dislocation rosettes is suppressed by baking specimens in air. Contrary to the case of II–VI compounds, illumination of visible light during indentation enhances the mobility of dislocations. These experimental results are discussed in terms of an effect of electronic charge of dislocation on its mobility.     

Role of interactions of triplets of atoms in the formation of elastic properties of cubic crystals

It is widely known that the interaction of triplets of particles (which are not reducible to the sum of pair interactions) play an important role in formation the nonlinear and anisotropic properties of crystals. The aim of this work is to establish a general form of the dependence of these properties on interactions of triplets of atoms that is dependent only on the structure of the crystals. To separate the interactions of triplets of atoms from those of quadruples, we assume that the energy of triplets of interacting atoms depends only on the characteristics of a triangle whose vertices are the centers of gravity of interacting atoms. In this model, the internal energy must therefore be invariant upon rearrangement of the numbers of interacting atoms and any rotation of the triangle in isotropic space, P(3) × O(3). To specify the form of energy dependence on characteristics of selected triangles, we constructed an integral rational basis of invariants in dependence on the components of the vectors connecting the vertices of each triangle. Using the example of a simple dependence of the energy on basic invariants, we show how to move from the assumed energy dependence on invariants to the dependence of energy on lattice sums.     

The effect of intermolecular interactions on photoluminescence of a porphyrin side-chain polymer

Photoluminescence properties and exciton decay dynamics in a porphyrin side-chain polymer, poly[porphyrin acrylate- acrylonitrile (abbreviated p[(por)A-AN]), have been investigated by femtosecond time-resolved photoluminescence spectroscopy. All the luminescences of p[(por)A-AN] films are due to the emissive decay of the photoexcited singlet excitons in the porphyrins. The luminescence efficiencies and lifetimes are increased for samples from pure films to dilute blend films. However, they are increased as the intrachain concentration of the porphyrin sidechain groups is decreased. The intrachain rotation motions of porphyrin sidechain groups result in the initial ultrafast luminescence decays, which are much faster than those due to the interchain interactions. All the samples show no significant red-shift and broadening of the transient luminescence spectra. The interchain and intrachain nonradiative exciton relaxation processes may play an important role in the luminescence dynamics in the p[(por)A-AN] films. The possible origin of different intrachain and interchain dynamic behaviours in p[(por)A-AN] films is discussed.