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Grain boundary atomic structures and light-element visualization in ceramics: combination of Cs-corrected scanning transmission electron microscopy and first-principles calculations

Yumi H. Ikuhara2011-08-01Microscopy

Grain boundaries and interfaces of crystals have peculiar electronic structures, caused by the disorder in periodicity, providing the functional properties, which cannot be observed in a perfect crystal. In the vicinity of the grain boundaries and interfaces, dopants or impurities are often segregated, and they play a…

Advanced Electron Microscopy Techniques and ApplicationsX-ray Spectroscopy and Fluorescence AnalysisElectron and X-Ray Spectroscopy Techniques

Possible Lattice Distortions in the Hubbard Model for Graphene

Rupert L. Frank、Élliott H. Lieb2011-08-01Physical Review Letters

The Hubbard model on the honeycomb lattice is a well-known model for graphene. Equally well known is the Peierls type of instability of the lattice bond lengths. In the context of these two approximations we ask and answer the question of the possible lattice distortions for graphene in zero magnetic field. The answer…

Graphene research and applicationsTopological Materials and PhenomenaFullerene Chemistry and Applications

Further Insights on the Pitting Corrosion of Stainless Steels

Bernard Baroux2011-08-01OpenAlex

Fundamentals of the pitting mechanisms have been discussed in this book by Strehblow and Marcus and the whole question of pitting corrosion was reviewed by SzlarskaSmialowska1 and Frankel.2 It is intended here to shed light on some points investigated on industrial stainless steels exposed to neutral or weakly acidic…

Corrosion Behavior and InhibitionHydrogen embrittlement and corrosion behaviors in metals

Intra- and Interatomic Spin Interactions by the Density Functional Theory plusUApproach: A Critical Assessment

Yachao Zhang、Hong Jiang2011-08-01Journal of Chemical Theory and Computation

Accurate evaluation of the total energy difference between different spin states in molecular magnetic systems is currently a great challenge in theoretical chemistry. In this work we assess the performance of the density functional theory plus the Hubbard U (DFT+U) approach for the first-principles description of the…

Magnetism in coordination complexesLanthanide and Transition Metal ComplexesMetal-Catalyzed Oxygenation Mechanisms

Polypropylene hybrid composites filled by wood flour and short glass fiber: Effect of compatibilizer on structure and properties

Xiuju Zhang、Huajun Yang、Zhidan Lin 等 4 位作者2011-08-01Journal of Thermoplastic Composite Materials

Polypropylene (PP) hybrid composites filled with wood flour (WF) and short glass fiber were prepared by melt blending and injection molding. Maleic anhydride-grafted PP (PP-g-MA), glycidyl methacrylate-grafted PP (PP-g-GMA), maleic anhydride-grafted ethylene-octene copolymer (POE-g-MA), and maleic anhydride-grafted hy…

Polymer Nanocomposites and PropertiesNatural Fiber Reinforced CompositesFiber-reinforced polymer composites

Effects of Ag nanoparticles on survival and oxygen consumption of zebra fish embryos,Danio rerio

Dominique A. Cowart、Stephanie Guida、Shreya Shah 等 4 位作者2011-08-01Journal of Environmental Science and Health Part A

Ultrafine silver (Ag) particles, defined as having one dimension in 1-100 nanometer (nm) size range, pose a unique threat to aquatic ecosystems due to their wide use in the healthcare and commercial industries. Previous studies have demonstrated some consequences of nanosilver exposure for earlier life stages of aquat…

Nanoparticles: synthesis and applicationsGold and Silver Nanoparticles Synthesis and ApplicationsAdvanced Nanomaterials in Catalysis

Porous silicon based negative electrodes for lithium ion batteries

E. V. Astrova、G. V. Fedulova、И.А. Смирнова 等 6 位作者2011-08-01Technical Physics Letters

Various structures of macroporous silicon intended for the fabrication of lithium ion battery anodes have been studied. Macroporous membranes were prepared by the photoelectrochemical etching of n -type silicon wafers possessing various resistances, followed by the removal of the substrate. The porosity was increased…

Advancements in Battery MaterialsSemiconductor materials and devicesSilicon Nanostructures and Photoluminescence

Mechanical Properties of Kenaf - Unsaturated Polyester Composites: Effect of Fiber Treatment and Fiber Length

Ekhlas A. Osman、Anatoli Vakhguelt、Igor Sbarski 等 4 位作者2011-08-01Advanced materials research

Kenaf fibre is a natural fibre which is growing in popularity due environmental issues and its properties as filler. Unsaturated polyester was used in this investigation via add 1% MEKP concentration ratio as the catalyst. This matrix was combined with untreated kenaf fiber with various fiber sizes (1-6) mm and (10-30…

Mechanical Behavior of CompositesNatural Fiber Reinforced CompositesMechanical Engineering and Vibrations Research

Topotactic Synthesis and Crystal Structure of a Highly Fluorinated Ruddlesden–Popper-Type Iron Oxide, Sr3Fe2O5+xF2–x (x ≈ 0.44)

Yoshihiro Tsujimoto、Kazunari Yamaura、Naoaki Hayashi 等 10 位作者2011-08-01Chemistry of Materials

Topotactic reaction of the n = 2 Ruddlesden–Popper phase Sr 3 Fe 2 O 7−δ (δ ≈ 0.18) with polytetrafluoroethylene (PTFE) yields a highly fluorinated phase Sr 3 Fe 2 O 5+ x F 2– x ( x ≈ 0.44), compared with Sr 3 Fe 2 O 6 F 0.87 prepared by the reaction of Sr 3 Fe 2 O 6 and F 2 gas. Structure analyses based on powder neu…

Magnetic and transport properties of perovskites and related materialsMultiferroics and related materialsAdvanced Condensed Matter Physics

Phase-field simulation of domain structures in epitaxial BiFeO3 films on vicinal substrates

Benjamin Winchester、Pingping Wu、Long‐Qing Chen2011-08-01Applied Physics Letters

The ferroelectric domain structures of epitaxial BiFeO3 thin films on miscut substrates were studied using a phase-field model. The effects of substrate vicinality towards (100) are considered by assuming charge-compensated surface and film/substrate interface. The predicted domain structures show remarkable agreement…

Ferroelectric and Piezoelectric MaterialsMultiferroics and related materialsUnderwater Acoustics Research

Synthesis of monodispersed mesoporous spheres of submicron size amorphous silica

E. Yu. Trofimova、D. A. Kurdyukov、Yu. A. Kukushkina 等 5 位作者2011-08-01Glass Physics and Chemistry

A technique has been developed for synthesis of submicron monodispersed mesoporous spheres of amorphous silica from an alcohol-water-ammonia mixture by means of tetraethoxysilane hydrolysis in the presence of hexadecyltrimethylammonium bromide. The mechanism of sphere formation from aggregates of close-packed surfacta…

Photonic Crystals and ApplicationsMesoporous Materials and CatalysisAerogels and thermal insulation

Studies on the application properties of calcium sulfate whisker in silicone rubber composites

Jincheng Wang、Xin Pan、Yahong Xue 等 4 位作者2011-08-01Journal of Elastomers & Plastics

Novel room-temperature-vulcanized silicone rubber/calcium sulfate whisker composites have been prepared. Properties such as viscosity, hardness, tensile strength, elongation at break, and thermal stability were researched and compared. A combination of scanning electronic microscopy studies was used to characterize th…

Polymer Nanocomposites and PropertiesPolymer composites and self-healingSilicone and Siloxane Chemistry

Thermodynamic properties of stishovite by low-temperature heat capacity measurements and the coesite-stishovite transition boundary

Masaki Akaogi、M. Oohata、Hiroshi Kojitani 等 4 位作者2011-08-01American Mineralogist

The low-temperature isobaric heat capacity (C P ) of synthetic stishovite was measured between 2 and 311 K by the thermal relaxation method. The measured C P is considerably smaller than that of Holm et al. (1967) over the whole temperature range studied. The standard entropy, S o 298.15 , of stishovite obtained is 24…

Geological and Geochemical AnalysisGlass properties and applicationsClay minerals and soil interactions

Slow dynamics of the high density Gaussian core model

Atsushi Ikeda、Kunimasa Miyazaki2011-08-01The Journal of Chemical Physics

We numerically study crystal nucleation and glassy slow dynamics of the one-component Gaussian core model (GCM) at high densities. The nucleation rate at a fixed supercooling is found to decrease as the density increases. At very high densities, the nucleation is not observed at all in the time window accessed by long…

Material Dynamics and PropertiesGlass properties and applicationsTheoretical and Computational Physics

Thermal Responsive Shape Memory Polymers for Biomedical Applications

Jianwen Xu、Jie Song2011-08-01InTech eBooks

Shape memory polymers (SMPs) are a type of polymeric materials that can be programmed to memorize a less-constrained shape/configuration, subsequently assume a strained temporary shape/configuration, and then revert to the memorized shape/configuration upon triggering by an external stimulus Such responsiveness to sti…

Polymer composites and self-healingMarine Sponges and Natural ProductsPhotochromic and Fluorescence Chemistry

Characterization of the elongasome core PBP2 : MreC complex of Helicobacter pylori

Meriem El Ghachi、Pierre‐Jean Matteï、Chantal Ecobichon 等 13 位作者2011-08-01Molecular Microbiology

The definition of bacterial cell shape is a complex process requiring the participation of multiple components of an intricate macromolecular machinery. We aimed at characterizing the determinants involved in cell shape of the helical bacterium Helicobacter pylori. Using a yeast two-hybrid screen with the key cell elo…

Bacterial Genetics and BiotechnologyEscherichia coli research studiesEnzyme Structure and Function

Effect of nonmagnetic alkaline-earth dopants on magnetic properties of BiFeO3 thin films

Pai Li、Yuanhua Lin、Ce‐Wen Nan2011-08-01Journal of Applied Physics

Bi0.95A0.05FeO3 (A = Ba, Sr, Ca) thin films were deposited on (111) Pt/Ti/SiO2/Si substrates via chemical solution deposition. The magnetization of the doped specimens increases sharply as compared to that of pure BiFeO3, and it increases as the doped ionic radius gets larger. X-ray diffraction analysis reveals that t…

Ferroelectric and Piezoelectric MaterialsGeophysical and Geoelectrical MethodsMultiferroics and related materials

Synthesis, Characterization and Degradation of Novel Biodegradable Poly(butylene-co-hexamethylene carbonate) Copolycarbonates

Wenxiang Zhu、Wen Zhou、Chuncheng Li 等 7 位作者2011-08-01Journal of Macromolecular Science Part A

A series of high molecular weight poly(butylene-co-hexamethylene carbonate) (PBHC) copolycarbonates were synthesized by copolymerizations of dimethyl carbonate (DMC), 1,4-butanediol (BD) and 1,6-hexanediol (HD) via a two-step melt polycondensation method. Microstructure analysis determined by high-resolution 13C-NMR s…

Polymer crystallization and propertiesbiodegradable polymer synthesis and propertiesCarbon dioxide utilization in catalysis

Amorphous Materials: Properties, Structure, and Durability: Compositional dependent compressibility of dissolved water in silicate glasses

Wim J. Malfait、Carmen Sanchez‐Valle、P. Ardia 等 5 位作者2011-08-01American Mineralogist

The sound velocities and elastic properties of a series of hydrous rhyolite, andesite, and basalt glasses have been determined by Brillouin scattering spectroscopy at ambient conditions to elucidate the effect of glass composition on the compressibility of dissolved water. Both the adiabatic bulk (K S ) and shear modu…

Glass properties and applicationsBuilding materials and conservationMineralogy and Gemology Studies

Improving thermoelectric properties of p-type Bi2Te3-based alloys by spark plasma sintering

Di Li、Ruirui Sun、Xiaoying Qin2011-08-01Progress in Natural Science Materials International

High-performance (Bi2Te3)x(Sb2Te3)1−x bulk materials were prepared by combining fusion technique with spark plasma sintering, and their thermoelectric properties were investigated. The electrical resistivity and Seebeck coefficient increase greatly and the thermal conductivity decreases significantly with the increase…

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