Relaxor ferroelectricity and electric-field-driven structural transformation in the giant lead-free piezoelectric (Ba,Ca)(Ti, Zr)O-3

There is great interest in lead-free (Ba0.85Ca0.15)(Ti0.90Zr0.10)O-3 (15/10BCTZ) because of its exceptionally large piezoelectric response Liu and Ren, Phys. Rev. Lett. 103, 257602 (2009)]. In this paper, we have analyzed the nature of: (i) crystallographic phase coexistence at room temperature, (ii) temperature-and field-induced phase transformation to throw light on the atomistic mechanisms associated with the large piezoelectric response of this system. A detailed temperature-dependent dielectric and lattice thermal expansion study proved that the system exhibits a weak dielectric relaxation, characteristic of a relaxor ferroelectric material on the verge of exhibiting a normal ferroelectric-paraelectric transformation. Careful structural analysis revealed that a ferroelectric state at room temperature is composed of three phase coexistences, tetragonal (P4mm)+ orthorhombic (Amm2) + rhombohedral (R3m). We also demonstrate that the giant piezoresponse is associated with a significant fraction of the tetragonal phase transforming to rhombohedral. It is argued that the polar nanoregions associated with relaxor ferroelectricity amplify the piezoresponse by providing an additional degree of intrinsic structural inhomogeneity to the system.

三维简化Navier-Stokes方程的最优形式

<正> 引言 最近十多年,简化NS方程(以下记为SNS)的研究和计算有长足进展。由于在NS方程组中对粘性项的取舍不同,因而有几种不同的简化NS方程组,究竟哪种形式更合理,是需进一步探讨的一个问题。文献[1]利用原始NS方程及三种不同的简化NS方程组,对球的超音速绕流数值试验表明,其效果是不一样的。文献[3]也指出,如果SNS方程组的形式选择不当,会带来不可忽略的误差。从二维研究不难看出,目前广泛采用的三维SNS方程即粘性激波层方程组(VSL)及抛物化NS方程组(PNS),都不是最合理的简化形式。本文提出三维NS方程组的一种最好形式,称为修正的PNS方程组(记为MPNS),并论证它的合理性及精确度。

TrustedPals plataformarako middlewarearen inplementazioa eta simulazioa

Sistema banatuak zenbait konputagailu edo gailu autonomoaz osaturiko sareak dira, non algoritmo banatuen bidez partaide guztien lana koordinatzen da entitate bakarra izatearen irudia emanez. Eredu honi esker sistemaren sendotasuna handitzen da, posible baita sistemak aurrera jarraitzea zenbait partaidek huts egin arren. Sistema banatuak diseinatzeak badu zenbait zailtasun, prozesu guztien arteko koordinazioa lortu behar baita. Erronka nagusietako bat adostasuna edo consensus lortzea da; hau da, prozesu guztiak ados jartzea zerbait erabaki behar dutenean. Ingurune desberdinetan planteatu badaiteke ere, lan honetan Byzantine ingurunean egingo da. Ingurune honetan partaideen hutsegiteak ausaz gerta daitezke eta edozein momentutan. Horrez gain, hutsegite horiek edozein motakoak izan daitezke, hala nola, prozesu bat bertan behera geratzea edota prozesu baten eskaera okerra edo lekuz kanpokoa egitea. Aurkeztutako consensus arazoa garrantzi handikoa da sistema banatuen arloan, honen bitartez beste hainbat helburu lortu baitaitezke. Horien artean Secure Multy-party Computation (SMC) dugu, non sare banatu bateko partaide guztiek adostasuna lotu behar dute partaide bakoitzaren informazioa gainontzekoei ezkutatuz. Horren adibide bezala “aberatsaren arazoa” azaldu ohi da, non partaide guztiek aurkitu behar dute zein den beraien artean aberatsena, partaide bakoitzak gainontzekoen “aberastasuna” ezagutu ahal izan gabe. SMC erabili daiteke soluzioa emateko planteamendu bera jarraitzen duten aplikazio erreal askori, hala nola, enkante pribatuak edo bozketak. SMC inplementatu ahal izateko TrustedPals izeneko plataforma dugu, non diseinu modularra jarraituz smartcard bat eta algoritmo banatuak konbinatzen dira lehenengo consensus eta ondoren SMC lortzeko. Karrera amaierako proiektu honen helburua TrustedPals proposamenaren alde praktikoa jorratzea izango da. Horretarako proposamenaren algoritmo banatuak inplementatu eta simulatuko dira zenbait probetako kasuetan. Simulazioak bideratzeko gertaera diskretuko NS-3 simulagailuan erabiliko da. Simulazio eszenario desberdinak inplementatuko dira eta ondoren emaitzak aztertuko dira.

Regenerative amplifier with continuously variable pulse duration used in an optical parametric chirped-pulse amplification laser system for synchronous pumping

A Nd:glass regenerative amplifier has been set up to generate the pumping pulse with variable pulse width for an optical parametric chirped-pulse amplification (OPCPA) laser system. Each pulse of the pulse train from a cw self-mode-locking femtosecond Ti:sapphire oscillator is stretched to approximate to300 ps at 1062 nm to be split equally and injected into a nonlinear crystal and the Nd:glass regenerative amplifier, as the chirped signal pulse train and the seed pulse train of the pumping laser system, respectively. By adjusting the cavity length of the regenerative amplifier directly, the width of amplified pulse could be varied continuously from approximate to300 ps to approximate to3 ns. The chirped signal pulse for the OPCPA laser system and the seed pulse for the pumping laser system come from the same oscillator, so that the time jitter between the signal pulse and the pumping pulse in optical parametric amplification stages could be <10 ps. (C) 2003 Society of Photo-Optical Instrumentation Engineers.

Model studies of Ziegler-Natta olefin polymerization using group 3 and group 4 metallocenes

Evidence for the stereochemical isomerization of a variety of ansa metallocene compounds is presented. For the scandocene allyl derivatives described here, we have established that the process is promoted by a variety of salts in both ether and hydrocarbon solvents and is not accelerated by light. A plausible mechanism based on an earlier proposal by Marks, et al., is offered as an explanation of this process. It involves coordination of anions and/or donor solvents to the metal center with cation assistance to encourage metalcyclopentadienyl bond heterolysis, rotation about the Si-Cp bond of the detached cyclopentadienide and recoordination of the opposite face. Our observations in some cases of thermodynamic racemic:meso ratios under the reaction conditions commonly used for the synthesis of the metallocene chlorides suggests that the interchange is faster than metallation, such that the composition of the reaction mixture is determined by thermodynamic, not kinetic, control in these cases.

Two new ansa-scandocene alkenyl compounds react with olefins resulting in the formation of η³-allyl complexes. Kinetics and labeling experiments indicate a tuck-in intermediate on the reaction pathway; in this intermediate the metal is bound to the carbon adjacent to the silyllinker in the rear of the metallocene wedge. In contrast, reaction of permethylscandocene alkenyl compounds with olefins results, almost exclusively, in vinylic C-H bond activation. It is proposed that relieving transition state steric interactions between the cyclopentadienyl rings and the olefin by either linking the rings together or using a larger lanthanide metal may allow for olefin coordination, stabilizing the transition state for allylic σ-bond metathesis.

A selectively isotopically labeled propylene, CH₂CD(¹³CH₃), was synthesized and its polymerization was carried out at low concentration in toluene solution using isospecific metallocene catalysts. Analysis of the NMR spectra (¹³C, ¹H, and ²H) of the resultant polymers revealed that the production of stereoerrors through chain epimerization proceeds exclusively by the tertiaryalkyl mechanism. Additionally, enantiofacial inversion of the terminally unsaturated polymer chain occurs by a non-dissociative process. The implications of these results on the mechanism of olefin polymerization with these catalysts is discussed.

碱金属氟化物对掺Yb~(3+)氟磷酸盐玻璃析晶稳定性和光谱性质的影响

研究了碱金属氟化物对掺Yb3+氟磷玻璃的光谱性质和析晶稳定性能的影响。运用倒易法计算了Yb3+的发射截面。结果显示,LiF的引入对吸收和发射截面的提高作用较大并出现最佳引入量极值,其次为KF。碱金属氟化物的引入可提高二元体系的析晶稳定性能,使玻璃网络结构得到改善;拉曼光谱显示二元体系中引入YbF3后玻璃网络结构得到增强,而在引入碱金属氟化物的三元体系中掺杂YbF3后破坏了网络完整性,降低系统析晶稳定性能。

Integração regional no leste asiático: ASEAN, ASEAN+3 e a disputa pela liderança regional

A presente dissertação tem como objetivo analisar as relações internacionais no Leste Asiático tendo como foco principal a pesquisa do fenômeno da integração regional e da disputa pela liderança na região através dos mecanismos de integração, por suas principais potências locais, China e Japão. A Associação dos Países do Sudeste Asiático (ASEAN) e seu desdobramento estrutural, a ASEAN+3 que inclui os dez países membros da associação além dos três países mais influentes do Nordeste Asiático, China, Japão e Coréia do Sul, são o objeto da pesquisa, uma vez que por serem os principais mecanismos de integração da região, estão mais sujeitos a vivenciar a concorrência chinesa e japonesa pelo papel de principal ator e líder regional. A crescente importância dos mecanismos de integração do Leste Asiático decorrente da maior integração que vem adquirindo, uma integração com particularidades únicas e bem distintas da União Europeia, traz o aumento da representatividade da região no mundo e de seus países membros dentro da região. Este tipo de destaque adquirido por este padrão de arcabouço regional, que proporciona crescimento das trocas comerciais na região e de seu desenvolvimento, passou a atrair as potências regionais por se constituir em um importante e interessante instrumento de política regional. Os Estados japonês e chinês possuem problemas históricos de longa data, o que traz maior desconfiança e instabilidade para a região, e aumenta a competição entre os dois atores por maior influência nos grupos de integração regional, acreditando ser possível através desta manobra alcançar a liderança regional. Deste modo, o que esta dissertação pretende mostrar é: a forma como japoneses e chineses se utilizam dos mecanismos de integração regional com a ASEAN e a ASEAN+3 em evidência para perpetuar sua política na região como forma de alcançar o poder; apresentar quais os objetivos, benefícios e interesses em se tornar o líder regional; e apontar qual país tem maior potencial em se tornar líder e através de que tipo de liderança.

U-transformation-finite element method in 3-dimensional analysis of orthotropic laminates

For an orthotropic laminate, an equivalent system with doubly cyclic periodicity is introduced. Then a 3-dimensional finite element model for the equivalent system is transformed into the unitary space, where the large finite element matrix equation is decoupled into some small matrix equations. Such a decoupling very efficiently reduces the computational effort. For an orthotropic laminate with four clamped edges, no exact elasticity solution is available, and the deflection values predicted by different methods have a considerable difference each other for a small length-to-thickness ratio. The present predictions are the largest because the present method is a full 3-dimensional finite element analysis without superfluous constraints. Illustrative numerical examples are presented to observe the distributions of stresses through the thickness of the laminates. (C) 2010 Elsevier Ltd. All rights reserved.

Crystal structure of microwave dielectric ceramics Ba[(Mg1-xCdx)(0.33)Nb-0.67]O-3

A series of complex perovskite solid solutions of Ba[(Mg1-xCdx)(0.33)Nb-0.67]O-3 have been synthesized by the columbite method. Detailed Rietveld refinement of their X-ray diffraction data show that Ba[(Mg1-xCdx)0(.33)Nb(0.67)]O-3 has an order trigonal structure. The ordering degree as determined by the B-site occupancies increases with the partial substitution of Cd for Mg.

Electrogenerated chemiluminescence sensors using Ru(bpy)(3)(2+) doped in silica nanoparticles

A novel electrogenerated chemiluminescence (ECL) sensor based on Ru(bpy)(3)(2+)-doped silica (RuDS) nanoparticles conjugated with a biopolymer chitosan membrane was developed. These uniform RuDS nanoparticles ( similar to 40 nm) were prepared by a water-in-oil microemulsion method and were characterized by electrochemical and transmission electron microscopy technology. The Ru( bpy)(3)(2+)-doped interior maintained its high ECL efficiency, while the exterior nanosilica prevented the luminophor from leaching out into the aqueous solution due to the electrostatic interaction. This is the first attempt to branch out the application of RuDS nanoparticles into the field of ECL, and since a large amout of Ru(bpy)(3)(2+) was immobilized three-dimensionally on the electrode, the Ru( bpy)(3)(2+) ECL signal could be enhanced greatly, which finally resulted in the increased sensitivity. This sensor shows a detection limit of 2.8 nM for tripropylamine, which is 3 orders of magnitude lower than that observed at a Nafion-based ECL sensor. Furthermore, the present ECL sensor displays outstanding long-term stability.

聚(苯乙烯-丙烯酸)镨配合物中单体链段分布与配合物催化活性的关系

合成并表征了聚(苯乙烯(S)-丙烯酸(A))镨配合物(SAAC·Pr)。红外光谱表明它具有双配位结构:Pr?C—R。计算了共聚物中单体单元的序列分布。苯乙烯和丙烯酸单元长序列分布随其在共聚物中含量的增加而增加。当丙烯酸长序列分布高时,配合物的催化活性低。苯乙烯和丙烯酸的平均链长分别为ns=3,nA=1时,配合物的催化活性最高。

Characterisation and glucoregulatory actions of a novel acylated form of the (Pro(3))GIP receptor antagonist in type 2 diabetes

In this study, we tested the biological activity of a novel acylated form of (Pro(3))glucose-dependent insulinotropic polypetide [(Pro3)GIP] prepared by conjugating palmitic acid to Lys(16) to enhance its efficacy in vivo by promoting binding to albumin and extending its biological actions. Like the parent molecule (Pro(3))GIP, (Pro(3))GIPLys(16)PAL was completely stable to the actions of DPP-IV and significantly (p <0.01 to p <0.001) inhibited GIP-stimulated cAMP production and cellular insulin secretion. Furthermore, acute administration of (Pro(3))GIPLys(16)PAL also significantly (p <0.05 to p <0.001) countered the glucose-lowering and insulin-releasing actions of GIP in ob/ob mice. Daily injection of (Pro(3))GIPLys(16)PAL (25 nmol/kg bw) in 14-18-week-old ob/ob mice over 14 days had no effect on body weight, food intake or non-fasting plasma glucose and insulin concentrations. (Pro(3))GIPLys(16)PAL treatment also failed to significantly alter the glycaemic response to an i.p. glucose load or test meal, but insulin concentrations were significantly reduced (1.5-fold; p <0.05) after the glucose load. Insulin sensitivity was enhanced (1.3-fold; p <0.05) and pancreatic insulin was significantly reduced (p <0.05) in the (Pro(3))GIPLys(16)PAL-treated mice. These data demonstrate that acylation of Lys(16) with palmitic acid in (Pro(3))GIP does not improve its biological effectiveness as a GIP receptor antagonist.

Solvation of 1-butyl-3-methylimidazolium hexafluorophosphate in aqueous ethanol - a green solution for dissolving 'hydrophobic' ionic liquids

The relatively hydrophobic ionic liquid 1-butyl-3-methylimidazolium hexafluorophosphate has been found to be totally miscible with aqueous ethanol between 0.5 and 0.9 mol fraction ethanol, whereas the ionic liquid is only partially miscible with either pure water or absolute ethanol; the ability to dissolve 1-butyl-3-methylimidazolium hexafluorophosphate in a 'green' aqueous solvent system has important implications for cleaning, purification, and separations using ionic liquids.

High-affinity NO(3-)-H+ cotransport in the fungus Neurospora:induction and control by pH and membrane voltage

High-affinity nitrate transport was examined in intact hyphae of Neurospora crassa using electrophysiological recordings to characterize the response of the plasma membrane to NO3- challenge and to quantify transport activity. The NO3(-)-associated membrane current was determined using a three electrode voltage clamp to bring membrane voltage under experimental control and to compensate for current dissipation along the longitudinal cell axis. Nitrate transport was evident in hyphae transferred to NO3(-)-free, N-limited medium for 15 hr, and in hyphae grown in the absence of a nitrogen source after a single 2-min exposure to 100 microM NO3-. In the latter, induction showed a latency of 40-80 min and rose in scalar fashion with full transport activity measurable approx. 100 min after first exposure to NO3-; it was marked by the appearance of a pronounced sensitivity of membrane voltage to extracellular NO3- additions which, after induction, resulted in reversible membrane depolarizations of (+)54-85 mV in the presence of 50 microM NO3-; and it was suppressed when NH4+ was present during the first, inductive exposure to NO3-. Voltage clamp measurements carried out immediately before and following NO3- additions showed that the NO3(-)-evoked depolarizations were the consequence of an inward-directed current that appeared in parallel with the depolarizations across the entire range of accessible voltages (-400 to +100 mV). Measurements of NO3- uptake using NO3(-)-selective macroelectrodes indicated a charge stoichiometry for NO3- transport of 1(+):1(NO3-) with common K(m) and Jmax values around 25 microM and 75 pmol NO3- cm-2sec-1, respectively, and combined measurements of pHo and [NO3-]o showed a net uptake of approx. 1 H+ with each NO3- anion. Analysis of the NO3- current demonstrated a pronounced voltage sensitivity within the normal physiological range between -300 and -100 mV as well as interactions between the kinetic parameters of membrane voltage, pHo and [NO3-]o. Increasing the bathing pH from 5.5 to 8.0 reduced the current and the associated membrane depolarizations 2- to 4-fold. At a constant pHo of 6.1, driving the membrane voltage from -350 to -150 mV resulted in an approx. 3-fold reduction in the maximum current and a 5-fold rise in the apparent affinity for NO3-. By contrast, the same depolarization effected an approx. 20% fall in the K(m) for transport as a function in [H+]o. These, and additional results are consistent with a charge-coupling stoichiometry of 2(H+) per NO3- anion transported across the membrane, and implicate a carrier cycle in which NO3- binding is kinetically adjacent to the rate-limiting step of membrane charge transit. The data concur with previous studies demonstrating a pronounced voltage-dependence to high-affinity NO3- transport system in Arabidopsis, and underline the importance of voltage as a kinetic factor controlling NO3- transport; finally, they distinguish metabolite repression of NO3- transport induction from its sensitivity to metabolic blockade and competition with the uptake of other substrates that draw on membrane voltage as a kinetic substrate.

Geração de simuladores de filas para diferentes contextos com estudo de casos para redes de computadores

Coordenação de Aperfeiçoamento de Pessoal de Nível Superior (CAPES)