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Density functional theory study of Fe3Ga

C. Paduani、Cristina Bormio-Nunes2011-02-01Journal of Applied Physics

First-principles scalar relativistic calculations in supercells of 16 atoms are used to represent disordered B2 ordering of Fe3Ga in order to observe the effect of Ga–Ga pairs on the electronic structure of this alloy. From a comparison with pure bcc Fe it is observed that the energy position and occupation of eg and…

Magnetic properties of thin filmsMicrostructure and Mechanical Properties of SteelsMagnetic Properties and Applications

Periplogenin, Isolated fromLagenaria siceraria, Ameliorates L-T4-induced Hyperthyroidism and Associated Cardiovascular Problems

Sunanda Panda、Anand Kar2011-02-01Hormone and Metabolic Research

The importance of glycoside in the regulation of thyroid dysfunction is not well understood. In the present investigation, effects of periplogenin-3- O-D-glucopyranosyl (1→6)(1→4)-D-cymaropyranoside, isolated from the vegetable, LAGENARIA SICERARIA, in L-thyroxine (L-T₄)-induced hyperthyroidism and in related cardiova…

Phytochemistry and Bioactive Compounds

Synthesis of Red Phosphor CaZrO 3 :Eu 3+ for White Light-Emitting Diodes

Xu Li、Li Guan、Jiayi An 等 8 位作者2011-02-01Chinese Physics Letters

A red-emitting CaZrO 3 :Eu 3+ phosphor has been prepared by solid state reaction and its luminescent properties are studied. The crystal structure is investigated by the x-ray diffraction. Through energy transitions of 5 D 0 → 7 F J (J = 0, 1, 2, 3) in Eu 3+ ions, the emission spectrum of the phosphor shows a series o…

Luminescence Properties of Advanced MaterialsPerovskite Materials and ApplicationsRadiation Detection and Scintillator Technologies

FABRICATION AND PROPERTIES OF SILICONE RUBBER/ZnO NANOCOMPOSITES VIA IN SITU SURFACE HYDROSILYLATION

Zhijie Yuan、Weihua Zhou、Ting Hu 等 7 位作者2011-02-01Surface Review and Letters

The silicone rubber (SR) nanocomposites have been successfully prepared via the in situ hydrosilylation reaction in the presence of pristine ZnO and vinyl silane modified ZnO ( SiVi@ ZnO ) nanoparticles. The structure of the pristine ZnO and SiVi @ ZnO nanoparticles were analyzed by the Fourier transform infrared spec…

Polymer Nanocomposites and PropertiesSynthesis and properties of polymersSilicone and Siloxane Chemistry

Pollution Maintenance Techniques In Coastal High Voltage Installations

K. Siderakis、D. Pylarinos、Emmanuel Thalassinakis 等 5 位作者2011-02-01Zenodo (CERN European Organization for Nuclear Research)

Pollution of outdoor high voltage insulators is a common problem for utilities, with a considerable impact to power system reliability. In an effort to prevent possible flashovers due to pollution, many methods have been applied, aiming to improve the insulation performance, either by suppressing the formation of surf…

High voltage insulation and dielectric phenomenaInfrastructure Maintenance and MonitoringAerosol Filtration and Electrostatic Precipitation

Application of dissipative particle dynamics to natural convection in differentially heated enclosures

Eiyad Abu‐Nada2011-02-01Molecular Simulation

Dissipative particle dynamics with energy conservation (eDPD) was applied to study natural convection in differentially heated enclosures. The eDPD simulations were compared to finite volume (FV) solutions. It was found that the eDPD method appropriately predicts the temperature and flow fields inside the enclosure. T…

Nanofluid Flow and Heat TransferBlock Copolymer Self-AssemblyLattice Boltzmann Simulation Studies

Preparation and optical properties of Y 2 O 3 /SiO 2 powder

Xiaoyi Shen、Yuchun Zhai2011-02-01Rare Metals

Abstract Y(NO 3 ) 3 and NH 3 ·H 2 O were used as a raw materials, and nano‐Y 2 O 3 powder was successfully synthesized by a precipitation method. Employing TEOS as a raw material, SiO 2 powder was successfully prepared by a alkoxide‐hydrolysis method, and a Y 2 O 3 /SiO 2 composite powder was obtained by coating. The…

Luminescence Properties of Advanced MaterialsGlass properties and applicationsNuclear materials and radiation effects

TrimethylamineN-oxide as a versatile cryoprotective agent in macromolecular crystallography

Christoph Mueller‐Dieckmann、Brice Kauffmann、M.S. Weiss2011-02-01Journal of Applied Crystallography

The surge of macromolecular crystallography is intimately linked to the advent of methods for cryoprotecting macromolecular crystals. Only if crystals are kept cold during data collection can they withstand the effects of radiation damage during a diffraction experiment, especially at third-generation synchrotron sour…

Enzyme Structure and FunctionIon-surface interactions and analysisBiochemical and Molecular Research

Electron energy loss spectroscopy investigation of Pb and Ti hybridization with O at the PbTiO3/SrTiO3 interface

E. Eberg、Antonius T. J. van Helvoort、Ryota Takahashi 等 8 位作者2011-02-01Journal of Applied Physics

Studies of oxide interfaces, and how they affect physical properties, have recently gained large attention. For ferroelectric materials, the evolution of the order parameter close to an interface is important to understand regarding the stability of the ferroelectric phase, and how to optimize devices taking advantage…

Ferroelectric and Piezoelectric MaterialsMultiferroics and related materialsElectronic and Structural Properties of Oxides

Effect of Precipitation Method and Ce Doping on the Catalytic Activity of Copper Manganese Oxide Catalysts for CO Oxidation

Xuebin Zhang、Kuoyan Ma、Ling-hui Zhang 等 6 位作者2011-02-01Chinese Journal of Chemical Physics

The influence of Ce doping and the precipitation method on structural properties and the catalytic activity of copper manganese oxides for CO oxidation at ambient temperature have been investigated. The catalysts were characterized by means of the powder X-ray diffraction and N2 adsorption-desorption, the inductively…

Catalytic Processes in Materials ScienceCatalysis and Oxidation ReactionsCopper-based nanomaterials and applications

Martensitic transformation in Cu-doped NiMnGa magnetic shape memory alloys

Panpan Li、Jingmin Wang、Chengbao Jiang2011-02-01Chinese Physics B

This paper studies the martensitic transformation in the Cu-doped NiMnGa alloys. The orthorhombic martensite transforms to L21 cubic austenite by Cu substituting for Ni in the Ni50−xCuxMn31Ga19 (x=2−10) alloys, the martensitic transformation temperature decreases significantly with the rate of 40 K per Cu atom additio…

Magnetic and transport properties of perovskites and related materialsShape Memory Alloy TransformationsCreativity in Education and Neuroscience

Properties of polypropylene/(natural rubber)/organomontmorillonite nanocomposites prepared by melt blending

Chaouki Bendjaouahdou、Salima Bensaad2011-02-01Journal of Vinyl and Additive Technology

Abstract The aim of this work was to study the effects of an organomontmorillonite or organoclay (OMMT) on the properties of a thermoplastic elastomer blend prepared by melt blending and based on polypropylene (PP) and natural rubber (NR). The results obtained showed a slight improvement of the blend mechanical (stren…

Polymer crystallization and propertiesPolymer Nanocomposites and PropertiesTribology and Wear Analysis

Study on the Properties of Boron-Containing Ores/Epoxy Composites for Slow Neutron Shielding

Zhe Fu Li、Xiang Xue、Tao Jiang 等 5 位作者2011-02-01Advanced materials research

Three kinds of low cost shielding materials using boron-containing ores and epoxy as starting materials were developed. The three boron-containing ores consist of natural green ore that is specific in China and the two artificial minerals that are boron-containing iron ore concentrate and boron-rich slag. They were go…

Nuclear Physics and ApplicationsRadiation Shielding Materials AnalysisGraphite, nuclear technology, radiation studies

Synthesis and characterization of p-type boron-doped IIb diamond large single crystals

李尚升、马红安、李小雷 等 7 位作者2011-02-01Chinese Physics B

High-quality p-type boron-doped IIb diamond large single crystals are successfully synthesized by the temperature gradient method in a china-type cubic anvil high-pressure apparatus at about 5.5 GPa and 1600 K. The morphologies and surface textures of the synthetic diamond crystals with different boron additive quanti…

High-pressure geophysics and materialsDiamond and Carbon-based Materials ResearchBoron and Carbon Nanomaterials Research

On the apparent lack of preferential site occupancy and electrooxidation of CO adsorbed at low coverage onto stepped platinum surfaces

Manuel J. S. Farias、Auro Atsushi Tanaka、Germano Tremiliosi‐Filho 等 4 位作者2011-02-01Electrochemistry Communications

We report time evolution studies of low coverage CO adsorption (surface hydrogen site blocking < 40%) and oxidative stripping on stepped Pt(776) and Pt(554) surfaces. It was observed that there is no preferential site occupancy for CO adsorption on step or terrace. It is proposed that CO adsorption onto these surfaces…

Electrocatalysts for Energy ConversionCatalytic Processes in Materials ScienceMolecular Junctions and Nanostructures

Evaluation of Sr2CoMoO6−δ as anode material in solid-oxide fuel cells: A neutron diffraction study

Ainara Aguadero、J. A. Alonso、R. Martínez-Coronado 等 5 位作者2011-02-01Journal of Applied Physics

The oxygen-deficient Sr2CoMoO6−δ double perovskite has been proposed as an anode material in solid-oxide fuel cells (SOFC). The evolution of its crystal structure has been followed by “in situ” temperature-dependent neutron powder diffraction from 23 °C (RT) to 867 °C in the heating and cooling runs in ultrahigh vacuu…

Advancements in Solid Oxide Fuel CellsMagnetic and transport properties of perovskites and related materialsAdvanced Condensed Matter Physics

Effects of Bi doping on the thermoelectric properties of β-Zn4Sb3

Xiaoying Qin、M. Liu、Lin Pan 等 6 位作者2011-02-01Journal of Applied Physics

The thermoelectric properties of Bi-doped compounds (Zn1−xBix)4Sb3 (x=0,0.0025,0.005,0.01) were studied experimentally as well as theoretically. The results indicate that low-temperature (T&amp;lt;300 K) thermal conductivity of moderately doped (Zn0.9975Bi0.0025)4Sb3 reduces remarkably as compared with that of Zn4Sb3…

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

Preparation of polylactic acid/epoxidized palm oil/fatty nitrogen compounds modified clay nanocomposites by melt blending

Emad A. Jaffar Al-Mulla2011-02-01Polymer Science Series A

In this study, new biopolymer nanocomposites have been prepared. Fatty nitrogen compounds (FNCs); fatty amide (FA), fatty hydroxamic acid (FHA), and carbonyl difatty amide (CDFA), which were synthesized from palm oil, have been used as one of organic compounds to modify natural clay (sodium montmorillonite). The clay…

Polymer Nanocomposites and Propertiesbiodegradable polymer synthesis and propertiesPolymer composites and self-healing

Pollution Maintenance Techniques in Coastal High Voltage Installations

K. Siderakis、D. Pylarinos、Emmanuel Thalassinakis 等 5 位作者2011-02-01Engineering Technology & Applied Science Research

Pollution of outdoor high voltage insulators is a common problem for utilities, with a considerable impact to power system reliability. In an effort to prevent possible flashovers due to pollution, many methods have been applied, aiming to improve the insulation performance, either by suppressing the formation of surf…

High voltage insulation and dielectric phenomenaInfrastructure Maintenance and MonitoringAerosol Filtration and Electrostatic Precipitation

Electric field‐induced self‐assembly of micro‐ and nanoparticles of various shapes at two‐fluid interfaces

Muhammad Mansoor Janjua、Sai Nudurupati、Pushpendra Singh 等 4 位作者2011-02-01Electrophoresis

Particle lithography which explores the capability of particles to self-assemble offers an attractive means to manufacture nanostructured materials. Although traditional techniques typically lead to the formation of dense crystals, adjustable non-close-packed crystals are crucial in a number of applications. We have r…

Micro and Nano RoboticsPickering emulsions and particle stabilizationElectrowetting and Microfluidic Technologies