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Lattice dynamics and thermal properties of Ca W O 4

Anatoliy Senyshyn、H. Kraus、V.B. Mikhailik 等 4 位作者2004-12-23Physical Review B

Thermodynamic properties of $\mathrm{Ca}\mathrm{W}{\mathrm{O}}_{4}$ were studied using the GULP code incorporating semiclassical simulations based on quasiharmonic lattice dynamics and static lattice minimisation methods. Free energy minimization along with so called ``relax'' fitting was used to obtain the parameters…

Luminescence Properties of Advanced MaterialsSolid-state spectroscopy and crystallographyThermal Expansion and Ionic Conductivity

Difference in surface degradation due to partial discharges between polyamide nanocomposite and microcomposite

Masahiro Kozako、Ryō Kido、Norikazu Fuse 等 6 位作者2004-12-23OpenAlex

Partial discharge (PD) degradation was investigated to compare polyamide nanocomposites with two kinds of polyamide microcomposites. Such materials were exposed to PDs under the IEC(b) electrode configuration for evaluation of PD resistance. Comparisons were made as to the surface roughness using a scanning electron m…

Advanced Sensor and Energy Harvesting MaterialsHigh voltage insulation and dielectric phenomenaDielectric materials and actuators

O 18 tracer diffusion in Pb(Zr,Ti)O3 thin films: A probe of local oxygen vacancy concentration

Ruey-Ven Wang、Paul C. McIntyre2004-12-23Journal of Applied Physics

A series of O18 tracer in-diffusion experiments have been conducted on state-of-the-art metal organic chemical vapor deposition–grown Pb(Zr,Ti)O3 (PZT) films. Prior to O18 incorporation, samples were preequilibrated in O216 at the same temperature and total pressure used for the following O218 isotope exchange anneal.…

Ferroelectric and Piezoelectric MaterialsMicrowave Dielectric Ceramics SynthesisElectronic and Structural Properties of Oxides

Active sites for NO reduction over Fe-ZSM-5 catalysts

Michael Schwidder、M. Santhosh Kumar、Angelika Brückner 等 4 位作者2004-12-23Chemical Communications

A study of Fe-ZSM-5 catalysts with variable amounts of isolated, oligomeric and heavily aggregated Fe3+ oxo sites (as evidenced by UV-Vis and EPR spectroscopic data) and their catalytic properties in the selective catalytic reduction of NO by isobutane or by NH3 is presented, which allows development of a unified conc…

Catalytic Processes in Materials ScienceCatalysis and Hydrodesulfurization StudiesCatalysis and Oxidation Reactions

Ferromagnetic resonance and ac conductivity of a polymer composite of Fe3O4 and Fe3C nanoparticles dispersed in a graphite matrix

N. Guskos、E. A. Anagnostakis、V. Likodimos 等 9 位作者2004-12-23Journal of Applied Physics

Ferromagnetic resonance (FMR) and ac conductivity have been applied to study a polymer composite containing as filler a binary mixture of magnetite (Fe3O4) and cementite (Fe3C) nanoparticles (30–50nm) dispersed in a diamagnetic carbon matrix, which was synthesized by the carburization of nanocrystalline iron. Ac condu…

Magnetic Properties and Synthesis of FerritesElectromagnetic wave absorption materialsIron oxide chemistry and applications

Role of the interface in determining the dielectric properties of nanocomposites

J. K. Nelson、L. A. Utracki、R.K. MacCrone 等 4 位作者2004-12-23OpenAlex

It has been demonstrated that the electrical breakdown properties of polymer composites can be substantially enhanced when the filler particles are of nanometric dimensions. These benefits are likely related to the mitigation and redistribution of internal charge. Using the example of an epoxy-TiO/sub 2/ nanodielectri…

High voltage insulation and dielectric phenomenaLightning and Electromagnetic PhenomenaPower Transformer Diagnostics and Insulation

Effect of nano-fillers on electrical treeing in epoxy resin subjected to AC voltage

H.-Z. Ding、B.R. Varlow2004-12-23OpenAlex

In the study, various amounts of nano- and micro-scale zinc oxide particles (62 nm and 1 /spl mu/m average diameter) were systematically introduced into an Araldite epoxy resin matrix for reinforcement purposes. The influence of these particles on the electrical treeing breakdown resistance was investigated experiment…

High voltage insulation and dielectric phenomenaLightning and Electromagnetic PhenomenaElectrical Fault Detection and Protection

Room temperature oxidation kinetics of Si nanoparticles in air, determined by x-ray photoelectron spectroscopy

De‐Quan Yang、Jean-Numa Gillet、Michel Meunier 等 4 位作者2004-12-23Journal of Applied Physics

The air oxidation kinetics of low coverages of ∼5nm Si nanoparticles, deposited by pulsed excimer laser ablation (KrF, 248 nm) in He, have been characterized by x-ray photoelectron spectroscopy. A simple model, based on the evolution of the Si 2p spectral components during oxidation, has been developed to determine th…

Semiconductor materials and devicesSilicon Nanostructures and PhotoluminescenceNanowire Synthesis and Applications

Lattice-dynamical calculation of phonon scattering at ideal Si–Ge interfaces

Hong Jian Zhao、Jonathan B. Freund2004-12-23Journal of Applied Physics

Detailed phonon scattering at an ideal Si–Ge interface is studied with a linear lattice dynamics model. Frequency dependent transmission coefficients indicate the significance of acoustic-optical phonon mode conversion at the interface. Applied to multiple interfaces, the method shows how the overall thermal resistanc…

Advanced Thermoelectric Materials and DevicesThermal properties of materialsThermal Radiation and Cooling Technologies

Dielectric properties of epoxy nanocomposites containing TiO/sub 2/, Al/sub 2/O/sub 3/ and ZnO fillers

J.C. Fothergill、J. K. Nelson、Mingli Fu2004-12-23OpenAlex

This work presents results of dielectric spectroscopy and space charge (PEA) measurements on epoxy resin filled with 10% w/w micro- and nano- sized particles of TiO/sub 2/, Al/sub 3/O/sub 2/ and ZnO. The results appear to show that the material from which the nano-particle is made is not highly significant in influenc…

Polymer Nanocomposites and PropertiesHigh voltage insulation and dielectric phenomenaDielectric materials and actuators

Competing structural instabilities in the ferroelectric Aurivillius compoundSrBi2Ta2O9

J. M. Pérez-Mato、M. I. Aroyo、Alberto Garcı́a 等 7 位作者2004-12-23Physical Review B

The Aurivillius family includes many compounds with ferroelectric phases. Despite sharing the basic perovskite structural block with more common ferroelectric oxides such as $\mathrm{Ba}\mathrm{Ti}{\mathrm{O}}_{3}$ or $\mathrm{Pb}\mathrm{Ti}{\mathrm{O}}_{3}$, their phase-transition behavior is rather more complex. In…

Ferroelectric and Piezoelectric MaterialsMultiferroics and related materialsMicrowave Dielectric Ceramics Synthesis

Magnetic properties of bulk Zn1−xMnxO and Zn1−xCoxO single crystals

Matthew H. Kane、K. Shalini、Christopher J. Summers 等 8 位作者2004-12-23Journal of Applied Physics

Manganese and cobalt-doped ZnO have been produced using a modified melt-growth technique. X-ray diffraction measurements indicate that the samples are high-quality single crystals with ω−2θ full width at half maximum values of 78 arc sec for the undoped ZnO and 252 arc sec for Zn1−xMnxO (x=0.05). The lattice parameter…

ZnO doping and propertiesMagnetic and transport properties of perovskites and related materialsCopper-based nanomaterials and applications

Spontaneous one dimensional arrangement of spherical Au nanoparticles with liquid crystal ligands

Insik In、Young‐wook Jun、Yun Jun Kim 等 4 位作者2004-12-23Chemical Communications

Spontaneous one dimensional arrangements of spherical Au nanoparticles were accomplished by using a liquid crystalline thiol ligand, 4'-(12-mercaptododecyloxy)biphenyl-4-carbonitrile. Simple thermal treatment of Au nanoparticles with the ligands showed 1D ordering of the Au nanoparticles.

Magnetic properties of thin filmsLiquid Crystal Research AdvancementsNanocluster Synthesis and Applications

Multivalent Carbocyanine Molecular Probes: Synthesis and Applications

Yunpeng Ye、Sharon Bloch、Jeffery Kao 等 4 位作者2004-12-23Bioconjugate Chemistry

Synergistic multivalent interactions can amplify desired chemical or biological molecular recognitions. We report a new class of multicarboxylate-containing carbocyanine dye constructs for use as optical scaffolds that not only serve as fluorescent antennas but also participate in structural assembly of the multivalen…

Supramolecular Chemistry and ComplexesLuminescence and Fluorescent MaterialsDendrimers and Hyperbranched Polymers

Photoelasticity of sodium silicate glass from first principles

Davide Donadio、Marco Bernasconi、F. Tassone2004-12-23Physical Review B

Based on density-functional perturbation theory we have computed the photoelastic tensor of a model of sodium silicate glass of composition ${({\mathrm{Na}}_{2}\mathrm{O})}_{0.25}{(\mathrm{Si}{\mathrm{O}}_{2})}_{0.75}$ (NS3). The model (containing 84 atoms) is obtained by quenching from the melt in combined classical…

High-pressure geophysics and materialsGlass properties and applicationsBuilding materials and conservation

Vancomycin Resistance in Enterococci Due to Synthesis of Precursors Terminating in d -Alanyl- d -Serine

Peter E. Reynolds、Patrice Courvalin2004-12-23Antimicrobial Agents and Chemotherapy

the intrinsically glycopeptide-resistant Enterococcus gallinarum, Enterococcus casseliflavus, and Enterococcus flavescens (VanC type) and is present in the VanE and VanG types in which E. faecalis has acquired the genes encoding vancomycin resistance. Some of the enzymes implicated in this second resistance mechanism…

Enzyme Structure and FunctionAmino Acid Enzymes and MetabolismBiopolymer Synthesis and Applications

Phonon scattering and stability of Na_0.5CoO_2

X. N. Zhang、P. Lemmens、V. Gnezdilov 等 8 位作者2004-12-23arXiv

Raman scattering experiments have been performed on Na_xCoO_2 as function of temperature at the composition x=0.5 where a structural instability and a metal-insulator transition have been observed. Three additional phonon modes are observed compared to samples with larger x. An in-situ annealing study (T_max=550 K) wi…

Materials ScienceStrongly Correlated Electrons

Improved pseudobonds for combined ab initio quantum mechanical/molecular mechanical methods

Yingkai Zhang2004-12-23The Journal of Chemical Physics

The pseudobond approach offers a smooth connection at the quantum mechanical/molecular mechanical interface which passes through covalent bonds. It replaces the boundary atom of the environment part with a seven-valence-electron atom to form a pseudobond with the boundary atom of the active part [Y. Zhang, T. S. Lee,…

Advanced Chemical Physics StudiesForce Microscopy Techniques and ApplicationsBoron and Carbon Nanomaterials Research

One-step solution-based catalytic route to fabricate novel α-MnO 2 hierarchical structures on a large scale

Zhengquan Li、Yue Ding、Yujie Xiong 等 5 位作者2004-12-23Chemical Communications

A new type of hierarchical structure, a core-shell structure with spherically aligned nanorods, was prepared via a simple room-temperature solution-based catalytic route in the case of alpha-MnO2.

Supercapacitor Materials and FabricationCatalytic Processes in Materials ScienceNanomaterials for catalytic reactions