Elastic,mechanical, electronic properties and hardness of Nb2AsC from first principles

The study aims at the elastic, mechanical, electronic properties and hardness of Nb₂AsC using first principles based on the density functional theory method within the generalised gradient approximation. The calculated lattice parameters of Nb₂AsC are in good agreement with the experimental data. The five independent elastic constants are firstly calculated as a function of pressure, and our results indicate that it is mechanically stable in the applied pressure. The elastic anisotropy is examined through the computation of the direction dependence of Young's modulus. The pressure dependences of the bulk modulus, shear modulus, average velocity of acoustic waves and Debye temperature of Nb₂AsC are systematically investigated. The band structure and density of states are discussed, and the results show that the strong hybridisations C p–Nb d and As p–Nb d would be beneficial to the structure stability of Nb₂AsC. Based on the Mulliken population analysis, the hardness of Nb₂AsC is predicted.     

Intermolecular multiple-quantum coherence NMR signals modulated by double distant dipolar fields

A modified CRAZED pulse sequence was applied to obtain the intermolecular multiple-quantum coherence NMR signals from double distant dipolar fields in highly polarized spin systems. Complete theoretical analyses were explicitly derived from the dipolar field treatment combined with product operator formalism. Two typical samples containing several different components were chosen for the experimental verifications. The computer simulations and experimental observations are consistent with the theoretical predictions. The results presented herein provide a convenient way to understand the combined effects of multiple distant dipolar fields from the different components in complicated chemical or biological solutions. When experimental conditions such as selective radio-frequency pulses are not optimal, it may be helpful to identify possible unexpected signals or artefacts of high-resolution NMR spectroscopy in inhomogeneous fields.     

Temperature effects of Hamiltonian dark solitons on the stability of holographic solitons in a separate holographic–Hamiltonian soliton pair

We investigate theoretically the temperature effects on the evolution and stability of a separate holographic–Hamiltonian dark–dark or bright–dark soliton pair formed in an unbiased serial photorefractive crystal circuit. Our numerical results show that, for a stable dark–dark or bright–dark soliton pair originally formed in a crystal circuit at given temperatures, when the crystal in which formed a Hamiltonian dark soliton changes, the holographic dark or bright soliton supported by the other crystal tends to evolve into another stable soliton or experiences larger cycles of compression or breaks up into beam filaments or exhibit a common decaying process. The holographic dark soliton is more sensitive to the temperature change than the holographic bright one.     

Structural and elastic properties of Ce2O3 under pressure from LDA+U method

We investigate the structural and elastic properties of hexagonal Ce₂O₃ under pressure using LDA+U scheme in the frame of density functional theory (DFT). The obtained lattice constants and bulk modulus agree well with the available experimental and other theoretical data. The pressure dependences of normalized lattice parameters a/a ₀ and c/c ₀, ratio c/a, and normalized primitive volume V/V ₀ of Ce₂O₃ are obtained. Moreover, the pressure dependences of elastic properties and three anisotropies of elastic waves of Ce₂O₃ are investigated for the first time. We find that the negative value of C ₄₄ is indicative of the structural instability of the hexagonal structure Ce₂O₃ at zero temperature and 30 GPa. Finally, the density of states (DOS) of Ce₂O₃ under pressure is investigated.     

电子商务中人类活动的标度行为实证研究

应用去趋势波动分析法,对电子商务中人类网上购物行为进行研究,首次探讨了人类浏览及购买行为时间序列(数量波动)标度律.首先,研究发现人类网上购物行为呈现出明显的周期性,其时间序列的概率密度函数具有显著的双模态特征.其次,利用傅里叶变换方法分析浏览以及购买行为时间序列的功率谱,发现其演化过程不同于无关联的泊松过程.最后,基于功率谱过滤周期性趋势的影响,对去除周期趋势后的浏览和购买行为时间序列进行去趋势波动分析,发现其标度行为表明其具有较强的长程关联特性,且平均标度值近似为1,表明其具有自组织临界性.实证研究结果与其他领域如因特网交通流和金融市场价格波动的标度行为相似,有助于理解人类活动如何影响电子商务系统演化和提高在线商务活动效率,对分析电子商务中人类行为活动的机制和预测其波动趋势具有重要的启示作用.     

高斯－谢尔模型光束的变换特性

在一般情况下推导出高斯－谢尔模型光束经ＡＢＣＤ光学系统变换后的相干模迭加表示式。     

Path decompositions of multigraphs

Let G be a loopless finite multigraph. For each vertex x of G, denote its degree and multiplicity by d(x) and μ(x) respectively. Define Ø(x) = the least even integer ≥ μ(x), if d(x) is even, the least odd integer ≥ μ(x), if d(x) is odd. In this paper it is shown that every multigraph G admits a faithful path decomposition—a partition P of the edges of G into simple paths such that every vertex x of G is an end of exactly Ø(x) paths in P. This result generalizes Lovász's path decomposition theorem, Li's perfect path double cover theorem (conjectured by Bondy), and a result of Fan concerning path covers of weighted graphs. It also implies an upper bound on the number of paths in a minimum path decomposition of a multigraph, which motivates a generalization of Gallai's path decomposition conjecture. © 1995 John Wiley & Sons, Inc.     

声表面波MIM隧道发光二极管

我们在研究MIM隧道发光结(金属-绝缘层-金属)的过程中,首次以表面声波代替表面随机粗糙度的作用,将MIM结制作在声表面波场中,结果使结的发光效率、发光强度、稳定性、均匀性都有改善.本文介绍了结的基本结构,基本工艺,阐明了结的发光机理,讨论了结的Ⅰ-Ⅴ特性曲线和光谱曲线,根据结具有显著的负阻现象,我们设计出了一种新型的开关器件.     

Preparation and gas chromatographic characterization of dibenzyl crown ether stationary phases

Summary Two crown ethers, di(tert-butylbenzo)-propyl-15-crown-5 polysiloxane (PSO-DTB-15C5) and dibenzo-propyl-15-crown-5 polysiloxane (PSO-DB-15C5) have been synthesized and coated onto fused-silica capillary columns. The chromatographic characteristics, including column efficiency, polarity, phase transition temperature, operating temperature range and selectivity, were studied.Excellent selectivity was obtained for the separation of polar position isomers, especially phenol and dinitrotoluene isomers. The separation mechanism is discussed.