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Order–disorder transition in monoclinic sulfur: a precise structural study by high-resolution neutron powder diffraction

William I. F. David、R.M. Ibberson、S. F. J. Cox 等 4 位作者2006-11-14Acta Crystallographica Section B Structural Science

High-resolution neutron powder diffraction has been used in order to characterize the order-disorder transition in monoclinic cyclo-octasulphur. Rapid data collection and the novel use of geometrically constrained refinements has enabled a direct and precise determination of the order parameter, based on molecular sit…

Solid-state spectroscopy and crystallographyThermal and Kinetic AnalysisChemical Thermodynamics and Molecular Structure

Three-particle correlation functions of quasi-two-dimensional one-component and binary colloid suspensions

Hau My Ho、Binhua Lin、Stuart A. Rice2006-11-14The Journal of Chemical Physics

We report the results of experimental determinations of the triplet correlation functions of quasi-two-dimensional one-component and binary colloid suspensions in which the colloid-colloid interaction is short ranged. The suspensions studied range in density from modestly dilute to solid. The triplet correlation funct…

Phase Equilibria and ThermodynamicsMaterial Dynamics and PropertiesTheoretical and Computational Physics

Synthesis of Fullerene‐like Cs2O Nanoparticles by Concentrated Sunlight

Ana Albu‐Yaron、T. Arad、Moshe Levy 等 10 位作者2006-11-14Advanced Materials

Application of a solar-driven synthesis approach for the production of fullerene-like Cs2O nanoparticles is presented (see figure). The synthesis is performed directly in evacuated quartz ampoules containing a Cs2O crystallite precursor under continuous irradiation with highly concentrated sunlight. Closed-cage nested…

Luminescence Properties of Advanced MaterialsPerovskite Materials and ApplicationsCrystal Structures and Properties

Adsorption of hydrogen on clean and modified magnesium films

Martin Johansson、Christopher W. Ostenfeld、Ib Chorkendorff2006-11-14Physical Review B

The sticking of hydrogen on $400\phantom{\rule{0.3em}{0ex}}\mathrm{\AA{}}$ thick magnesium films, grown under ultrahigh vacuum conditions, have been measured under conditions relevant for hydrogen storage, i.e., elevated temperatures and pressures. A model which describes the hydrogenation and desorption kinetics of t…

Magnesium Alloys: Properties and ApplicationsHydrogen Storage and MaterialsAmmonia Synthesis and Nitrogen Reduction

Production of Nanosized Carbon Black from Hydrocarbon by a Thermal Plasma

Hye-Min Yang、Won-Ki Nam、Dong-Wha Park2006-11-14Journal of Nanoscience and Nanotechnology

Thermal plasma conditions (optimal heat and radical sources for the thermal decomposition) can be used to accelerate thermodynamically favorable chemical reactions or provide the energy required for endothermic reforming processes. Direct thermal decomposition of hydrocarbon (methane, acetylene, and propane) was carri…

Carbon Nanotubes in CompositesGraphene research and applicationsDiamond and Carbon-based Materials Research

Local polymer dynamics under strong connectivity constraints: The dendrimer case

K. Karatasos、Alexey V. Lyulin2006-11-14The Journal of Chemical Physics

The characteristics of local motion are explored by molecular dynamics simulations in a series of AB(2)-type dendrimer melts. Systems of generations 3-5 were simulated in a wide temperature range, allowing the assessment of effects associated with molecular size, proximity to the detected glasslike transitions, and th…

Polymer crystallization and propertiesMaterial Dynamics and PropertiesRheology and Fluid Dynamics Studies

Cytotoxic Oxygenated Triterpenoid Saponins from Symplocos chinensis

Guangmiao Fu、Yue Liu、Shi‐Shan Yu 等 7 位作者2006-11-14Journal of Natural Products

A n-butanol-soluble fraction of an ethanolic extract from the roots of Symplocos chinensis showed cytotoxic activity against several cancer cell lines. Bioassay-guided purification led to the isolation and characterization of eight new triterpenoid saponins, symplocososides L-S (1-8). The structures of 1-8 were elucid…

Natural product bioactivities and synthesisPhytochemistry and Biological ActivitiesPhytochemistry and Bioactive Compounds

Liquid-liquid transition in supercooled water investigated by interaction with LiCl and Xe

R. Souda2006-11-14The Journal of Chemical Physics

The hypothesis that supercooled water consists of two distinct liquid phases has been explored on the basis of their ability to hydrate nonpolar (Xe) and electrolytic (LiCl) species. Xe incorporated in the bulk of amorphous solid water survives in the deeply supercooled regime above the glass-transition temperature of…

Material Dynamics and PropertiesGlass properties and applicationsThermodynamic properties of mixtures

Superspace-symmetry determination and multidimensional refinement of the incommensurately modulated structure of natural fresnoite

Luca Bindi、Michal Dušek、Vaclav Petricek 等 4 位作者2006-11-14Acta Crystallographica Section B Structural Science

The structure of natural fresnoite, Ba2TiSi2O8, from the sanbornite deposits of eastern Fresno County, California, has been solved and refined as an incommensurate structure in five-dimensional superspace. The structure is tetragonal, superspace group P4bm(alpha, alpha, 1/2)(-alpha, alpha, 1/2)0gg, cell parameters a=8…

Crystal Structures and PropertiesX-ray Diffraction in CrystallographyMineralogy and Gemology Studies

C60on strain-relief patterns ofAg∕Pt(111): Film orientation governed by template superstructure

Kamel Aït−Mansour、Pascal Ruffieux、Wende Xiao 等 6 位作者2006-11-14Physical Review B

The adsorption, growth and overlayer formation of ${\mathrm{C}}_{60}$ fullerene molecules on strain-relief patterns induced by 2 monolayers of Ag on Pt(111) (Ag(2ML)/Pt(111)) is investigated by means of scanning tunneling microscopy. The Ag(2ML)/Pt(111) template surface consists of periodic crossing dislocations separ…

Graphene research and applicationsFullerene Chemistry and ApplicationsSurface Chemistry and Catalysis

Unique Mechanical Properties of Nanostructured Metals

Nobuhiro Tsuji2006-11-14Journal of Nanoscience and Nanotechnology

Recently, it becomes possible to fabricate bulk metals having ultrafine grained or nanocrystalline structures of which grain size is in nano-meter dimensions. One of the promising ways to realize bulk nanostructured metals is severe plastic deformation (SPD) above logarithmic equivalent strain of 4. We have developed…

Microstructure and mechanical propertiesMetal and Thin Film MechanicsAdvanced Surface Polishing Techniques

On the crystal structure of Cr2N precipitates in high-nitrogen austenitic stainless steel. III. Neutron diffraction study on the ordered Cr2N superstructure

Tae‐Ho Lee、Sung-Joon Kim、Eunjoo Shin 等 4 位作者2006-11-14Acta Crystallographica Section B Structural Science

The ordered structure of Cr(2)N precipitates in high-nitrogen austenitic steel was investigated utilizing high-resolution neutron powder diffractometry (HRPD). On the basis of the Rietveld refinement of neutron diffraction patterns, the ordered Cr2N superstructure was confirmed to be trigonal (space group P31m), with…

Metal and Thin Film MechanicsMicrostructure and Mechanical Properties of SteelsHydrogen embrittlement and corrosion behaviors in metals

Laser Ablation Condensation, Coalescence, and Phase Change of Dense γ-Al 2 O 3 Particles

Chiennan Pan、Shuei-Yuan Chen、Pouyan Shen2006-11-14The Journal of Physical Chemistry B

Dense gamma-Al(2)O(3)condensates, with residual stress up to 3 GPa and ranging from nanometer to an unexpected micrometer size, were formed by pulsed laser ablation on Al target under oxygen background gas for a very rapid heating and cooling effect. Analytical electron microscopic observations indicated such nanopart…

Diamond and Carbon-based Materials ResearchIon-surface interactions and analysisLaser-Ablation Synthesis of Nanoparticles

Phase separation and percolation of reversibly aggregating spheres with a square-well attraction potential

Sujin B. Babu、Jean-Christophe Gimel、Taco Nicolaï2006-11-14The Journal of Chemical Physics

Reversible aggregation of spheres is simulated using a novel method in which clusters of bound spheres diffuse collectively with a diffusion coefficient proportional to their radius. It is shown that the equilibrium state is the same as with other simulation techniques, but with the present method more realistic kinet…

Material Dynamics and PropertiesTheoretical and Computational PhysicsPickering emulsions and particle stabilization

DFT Studies on the Magnetic Exchange Across the Cyanide Bridge

Mihail Atanasov、Peter Comba、Claude Daul2006-11-14The Journal of Physical Chemistry A

Exchange coupling across the cyanide bridge in a series of novel cyanometalate complexes with CuII-NC-MIII (M = Cr and low-spin Mn, Fe) fragments has been studied using the broken-symmetry DFT approach and an empirical model, which allows us to relate the exchange coupling constant with sigma-, pi-, and pi*-type spin…

Magnetic properties of thin filmsMagnetism in coordination complexesElectron Spin Resonance Studies

Relation between local diffusivity and local inherent structures in the Kob-Andersen Lennard-Jones model

Emilia La Nave、Srikanth Sastry、Francesco Sciortino2006-11-14Physical Review E

We analyze one thousand independent equilibrium trajectories of a system of 155 Lennard-Jones particles to separate in a model-free approach the role of temperature and the role of the explored potential energy landscape basin depth in the particle dynamics. We show that the diffusion coefficient D can be estimated as…

Phase Equilibria and ThermodynamicsMaterial Dynamics and PropertiesTheoretical and Computational Physics

Evolution of Enzymatic Activities in the Enolase Superfamily: d-Tartrate Dehydratase from Bradyrhizobium japonicum,

Wen Shan Yew、А.А. Федоров、E.V. Fedorov 等 6 位作者2006-11-14Biochemistry

We focus on the assignment of function to and elucidation of structure-function relationships for a member of the mechanistically diverse enolase superfamily encoded by the Bradyrhizobium japonicum genome (bll6730; GI:27381841). As suggested by sequence alignments, the active site contains the same functional groups f…

Protein Structure and DynamicsEnzyme Structure and FunctionAmino Acid Enzymes and Metabolism

Controllable Synthesis and Enhanced Electrochemical Properties of Multifunctional AucoreCo3O4shell Nanocubes

Jianqiang Hu、Zhenhai Wen、Qiang Wang 等 7 位作者2006-11-14The Journal of Physical Chemistry B

Multifunctional Au(core)Co(3)O(4shell) nanocubes were synthesized through the introduction of chloroauric acid (HAuCl(4)) into a typical hydrothermal system after a solvothermal process was completed to form metastable Co(3)O(4) hollow nanospheres in the presence of sodium dodecyl benzenesulfonate (SDBS), which served…

Quantum Dots Synthesis And PropertiesElectrochemical Analysis and ApplicationsCopper-based nanomaterials and applications

Characterization of the Drastic Increase in Molecular Mobility of a Deformed Amorphous Polymer

Étienne Munch、J.M. Pelletier、Bruno Sixou 等 4 位作者2006-11-14Physical Review Letters

Original experiments of dynamic mechanical analysis and small angle x-ray scattering on a deformed amorphous polymer below its glass transition temperature are reported. The mechanical treatment reveals high mobility zones induced by shearing and leads to a drastic increase in the molecular mobility of the system. The…

Liquid Crystal Research AdvancementsMaterial Dynamics and PropertiesGlass properties and applications

Luminescent amphiphilic dendrimers with oligo(p-phenylene vinylene) core branches and oligo(ethylene oxide) terminal chains: syntheses and stimuli-responsive properties

Dong Wook Chang、Liming Dai2006-11-14Journal of Materials Chemistry

A class of new dendrimers consisting of hydrophobic oligo(p-phenylene vinylene) core branches and hydrophilic oligo(ethylene oxide) terminal chains was synthesized. These amphiphilic dendritic molecules are highly luminescent and exhibit critical micellization behaviors. They also show a lower critical solution temper…

Advanced Polymer Synthesis and CharacterizationLuminescence and Fluorescent MaterialsDendrimers and Hyperbranched Polymers