Vibrational EELS and DFT study of propionic acid and pyruvic acid on Ni(1 0 0): Effects of keto group substitution on room-temperature adsorption and thermal chemistry

The room-temperature adsorption and thermally induced processes of propionic acid and pyruvic acid on Ni(1 0 0) have been investigated by electron energy loss spectroscopy (EELS). Computational vibrational analysis of the optimized bidentate structures for acid-Ni model complexes (involving the organic acid and a Ni atom) has been performed by using the two-layer ONIOM method with the Density Functional Theory and used to interpret the vibrational EELS data. Dehydrogenation of the hydroxyl group is found to result in bonding of the carboxylate group in the propionate and pyruvate adspecies to either a single Ni surface atom in a bidentate configuration or two neighbouring Ni atoms in a bridge configuration. Given the similarities in the total energies and related vibrational frequencies obtained by the calculations in the case of pyruvate adspecies, it is difficult to differentiate the alternate adsorption structure, in which the keto O and hydroxyl O atoms are bonded to a Ni atom in a five-member chelate ring configuration. Furthermore, temperature-dependent EELS studies show that both the propionate and pyruvate adspecies could decompose upon annealing to above 400 K and further dissociate to CO adspecies above 550 K and to C and/or O above 600 K.     

On existence and regularity of solutions for 2‐D micropolar fluid equations with periodic boundary conditions

In this paper, we prove the existence and uniqueness of a global solution for 2‐D micropolar fluid equation with periodic boundary conditions. Then we restrict ourselves to the autonomous case and show the existence of a global attractor. Copyright © 2006 John Wiley & Sons, Ltd.     

Effect of external Gaussian random field on phonon spectrum of linear atomic chains

We present the theoretical study of the effect of external random field characterized by a Gaussian probability distribution function on the continuous phonon spectrum of one-dimensional (1D) chain, based on the Jacobian matrix method. The cumulative effect of the random field and simple isotopic defect is studied analytically and numerically. The Gaussian random field removes a square-root divergence appearing in the phonon spectrum of ideal 1D chain. The impurity phonon DOS shows strong dependence on the variance and the mean of the random field and exhibits very different behavior from the non-random case: the continuous spectrum is expanded and the δ-peak, describing discrete impurity vibrations in the non-random chain with the impurity, falls into a continuous zone.     

Self‐curable polyester by a reaction of glycidol with maleic anhydride

The controlled reaction of equimolar quantities of maleic anhydride and glycidol in dimethoxyethane gives soluble polyesters with one hydroxyl group in each repeating unit. The reaction proceeds with stepwise ring opening of the components and gives highly viscous clear solutions in relatively short periods. In the first step, monomaleate ester formation takes place around 80 °C. The ring opening of the oxirane group is the second step, and it occurs at 120 °C. The overall reaction is the formation of soluble polyesters with moderate molecular weights (6000–18,000), without the elimination of water. The soluble polyesters can be crosslinked tightly by direct heating at 190 °C without additional vinyl monomer. © 2003 Wiley Periodicals, Inc. J Polym Sci Part A: Polym Chem 41: 2549–2555, 2003     

Positive solutions of singular boundary value problem of negative exponent Emden—Fowler equation

This paper investigates the existence of positive solutions of a singular boundary value problem with negative exponent similar to standard Emden-Fowler equation. A necessary and sufficient condition for the existence of C[0, 1] positive solutions as well as C¹[0, 1] positive solutions is given by means of the method of lower and upper solutions with the Schauder fixed point theorem.     

Precise measurement of magnetic moment of short-lived β-emitting nuclei12B ( I π=1+, T 1/2=20.18 ms)

The spin polarized β-emitting nuclei¹²B (I ^π=1⁺,T _1/2=20.18 ms) were produced by the nuclear reaction¹¹B(d, p)¹²B and by the selection technique of the incident deuteron energy and the¹²B recoil angle following the nuclear reaction. The nuclear magnetic moment of the short-lived nuclei¹²B was measured by β-NMR with the β-NMR and β-NQR setup established for the first time in China. The nuclear magnetic moment of¹²B was determined to be μ=0.99993±0.00048 nm org=0.99993±0.00048 after the precise correction of the Knight shift.     

Banach空间二阶周期边值问题解的存在性

利用一些比较结果，讨论了Banach空间中二阶周期边值问题解的存在性，获得了若干解的存在性与唯一性结果。     

THEORY AND APPLICATIONS OF MONOTONE SEMIFLOWS FOR FUNCTIONAL DIFFERENTIAL EQUATIONS

The theory of monotone semiflows has been widely applied to functional differential equations (FDEs). The studies on the theory and applications of monotone semiflows for FDEs are very important and interesting. A brief des-cription of our recent works are as follows.By using general monotone semiflow theory, several results of positively invariant sets, monotone solutions and contracting rectangles of retarded functional differential equations(RFDEs) with infinite delay are gained under the assumption of quasimonotonicity; sufficient conditions for the existence, un-iqueness and global attractivity of periodic solutions are also established by combining the theory of monotone semiflows for neutral functional differential equations(NFDEs) and Krasnoselskii's fixed point theorem.     

病毒感染群体动力学模型分析

本文构建并讨论了一类病毒感染的群体动力学模型,得到了模型存在轨道稳定周 期解的充分条件,较好地解释了在病毒持续感染者体内观察到的病毒载量波动现象.     

Multiplicity results for positive solutions of some semi-positone three-point boundary value problems

In this paper, some multiplicity results for positive solutions of some singular semi-positone three-point boundary value problem be obtained by using the fixed point index method.