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Calculating the hopping times of confined fluids: Two hard disks in a box

Richard K. Bowles、K. K. Mon、J. K. Percus2004-11-16The Journal of Chemical Physics

The dynamical transition between the anomalous single file diffusion of highly confined fluids and bulk normal diffusion can be described by a phenomenological model involving a particle hopping time tau(hop). We suggest a theoretical formalism that will be useful for the calculation of tau(hop) for a variety of syste…

Material Dynamics and PropertiesSpectroscopy and Quantum Chemical StudiesAdvanced Thermodynamics and Statistical Mechanics

Biodegradable hollow microfibres to produce bioactive scaffolds

Luigi Lazzeri、Maria Grazia Cascone、Simone Quiriconi 等 5 位作者2004-11-16Polymer International

Abstract Biodegradable hollow microfibres containing particles loaded with specific active agents can be potentially employed to produce a special kind of substrate for tissue engineering, able to function as a scaffold and at the same time to act as a drug‐releasing system. Biodegradable hollow microfibres based on p…

Bone Tissue Engineering Materialsbiodegradable polymer synthesis and propertiesElectrospun Nanofibers in Biomedical Applications

Tetrathiafulvalene–phosphine-based iron and ruthenium carbonyl complexes: Electrochemical and EPR studies

Cyril Gouverd、Frédéric Biaso、Laurent Cataldo 等 10 位作者2004-11-16Physical Chemistry Chemical Physics

The radical cation of the redox active ligand 3,4-dimethyl-3',4'-bis-(diphenylphosphino)-tetrathiafulvalene (P2) has been chemically and electrochemically generated and studied by EPR spectroscopy. Consistent with DFT calculations, the observed hyperfine structure (septet due to the two methyl groups) indicates a stro…

Metal complexes synthesis and propertiesMagnetism in coordination complexesOrganic and Molecular Conductors Research

Surface-enhanced Raman scattering from ordered Ag nanocluster arrays

Jason Schmidt、S. E. Cross、Steven K. Buratto2004-11-16The Journal of Chemical Physics

We have examined the effect of ordered silver nanocluster substrates on the surface-enhanced Raman spectrum of rhodamine 6G (R6G). Triangular shaped silver nanocluster arrays with order on the approximately 100 mum range were prepared using nanosphere lithography. Direct comparisons of R6G surface-enhanced Raman spect…

Gold and Silver Nanoparticles Synthesis and ApplicationsQuantum Dots Synthesis And PropertiesNanocluster Synthesis and Applications

Characterization of Aldehyde-PEG Tethered Surfaces: Influence of PEG Chain Length on the Specific Biorecognition

Hidenori Otsuka、Yukio Nagasaki、Kazunori Kataoka2004-11-16Langmuir

A functionalized poly(ethylene glycol) (PEG) layer possessing a reactive aldehyde group at the free end of the tethered PEG chain was constructed by simple coating on the substrate, using the acetal-PEG/poly(DL-lactide) block copolymer, followed by the hydrolysis of the acetal end group by an acid treatment. The react…

Advanced Polymer Synthesis and CharacterizationPolymer Surface Interaction StudiesAnalytical Chemistry and Sensors

A multichannel electron energy loss spectrometer for low-temperature condensed films

Donald E. David、D. B. Popović、Dean Antic 等 4 位作者2004-11-16The Journal of Chemical Physics

We describe a wide-gap multichannel cylindrical deflection electron energy analyzer suitable for measuring the weak signals characteristic of electronically inelastic electron energy loss spectra. The analyzer has nearly ideal fringing field termination, and its resolution and energy dispersion were characterized as a…

Advanced Chemical Physics StudiesCatalytic Processes in Materials ScienceElectron and X-Ray Spectroscopy Techniques

Particle size and morphology of poly[styrene‐co‐(butyl acrylate)]/nano‐silica composite latex

Hua Li、Bo You、Guangxin Gu 等 5 位作者2004-11-16Polymer International

Abstract Nanocomposite latex with nano‐silica of varying particle sizes was prepared via in situ polymerization and investigated by submicron particle size analysis, transmission electron microscopy (TEM), scanning electron microscopy (SEM), Fourier‐transform infrared spectrometry (FTIR) and Raman spectrometry. It was…

Advanced Polymer Synthesis and CharacterizationPolymer Nanocomposites and Propertiesbiodegradable polymer synthesis and properties

Self-Assembly and Crystallization in a Supramolecular Hairy Rod Polymer from the Complex of Polyaniline with ω-Methoxy Poly(ethylene oxide) Phosphates

Bhanu Nandan、Hsin‐Lung Chen、Chien‐Shiun Liao 等 4 位作者2004-11-16Macromolecules

A semirigid conjugated polyaniline (PANI) was complexed with a ω-methoxy poly(ethylene oxide) phosphate (PEOPA) through ionic bonding to yield a supramolecular hairy rod polymer comprised of an ionic PANI backbone and nonionic PEO side chains. The strong backbone−side chain repulsion resulted in a microphase-separated…

Organic Electronics and PhotovoltaicsConducting polymers and applicationsSupramolecular Self-Assembly in Materials

Monte Carlo simulation of structure and nanoscale interactions in polymer nanocomposites

Qiang Zhang、Lynden A. Archer2004-11-16The Journal of Chemical Physics

Off-lattice Monte Carlo simulations in the canonical ensemble are used to study polymer-particle interactions in nanocomposite materials. Specifically, nanoscale interactions between long polymer chains (N=550) and strongly adsorbing colloidal particles of comparable size to the polymer coils are quantified and their…

Phase Equilibria and ThermodynamicsMaterial Dynamics and PropertiesPolymer Nanocomposites and Properties

A comparative study of UV aging characteristics of poly(ethylene‐co‐vinyl acetate) and poly(ethylene‐co‐vinyl acetate)/carbon black mixture

Mehmet Çopuroğlu、Murat Şen2004-11-16Polymers for Advanced Technologies

Abstract In this comparative study, the effect of carbon black (CB) on the UV aging characteristics of poly(ethylene‐co‐vinyl acetate) (EVA) was investigated. EVA, containing 13% vinyl acetate (VA), and poly(ethylene‐co‐vinyl acetate)/carbon black mixture (EVA/CB), containing 13% VA and 1% CB, were aged by means of UV…

Polymer crystallization and propertiesPolymer Nanocomposites and Propertiesbiodegradable polymer synthesis and properties

Surface and bulk electronic structure ofLa1−xCaxVO3

Kalobaran Maiti、Ashwani Kumar、D. D. Sarma 等 5 位作者2004-11-16Physical Review B

We report on a photoemission study of the electronic structure of metallic ${\mathrm{La}}_{1\ensuremath{-}x}{\mathrm{Ca}}_{x}{\mathrm{VO}}_{3}$, with $x=0.4$ and 0.5, using monochromatized He I, He II, and Al $K\ensuremath{\alpha}$ radiations. He II spectra obtained using monochromatic source exhibit large intensity f…

Magnetic and transport properties of perovskites and related materialsAdvanced Condensed Matter PhysicsElectronic and Structural Properties of Oxides

Effect of polymerization conditions on o‐phenylenediamine and o‐phenetidine oxidative copolymers

Mei‐Rong Huang、Xin‐Gui Li、Wei Duan2004-11-16Polymer International

Abstract A series of new o ‐phenylenediamine (OPD)/ o ‐phenetidine (PHT) copolymers with partly phenazine‐like structures has been successfully synthesized at three polymerization temperatures by chemically oxidative polymerization in four different polymerization media. The molecular structures and properties of the…

Organic Electronics and PhotovoltaicsConducting polymers and applicationsSynthesis and properties of polymers

Imaging Takes a Quantum Leap

Diane S. Lidke、Donna J. Arndt‐Jovin2004-11-16Physiology

Semiconducting nanocrystals, or quantum dots (QDs), have emerged as a new tool in physiological imaging, combining high brilliance, photostability, broad excitation but very narrow emission spectra, and surface chemistry compatible with biomolecular conjugation. In this review, we demonstrate the power of QDs in diver…

Advanced biosensing and bioanalysis techniquesQuantum Dots Synthesis And PropertiesNanocluster Synthesis and Applications

Grain size dependence of optical properties and positron annihilation parameters in Bi2O3powder

Mahuya Chakrabarti、Sreetama Dutta、Surajit Chattapadhyay 等 6 位作者2004-11-16Nanotechnology

Nanocrystalline Bi 2 O 3 has been prepared by a ball milling process. The particle size of the ball-milled Bi 2 O 3 powder has been determined by the x-ray powder diffraction method and transmission electron microscopy. The absorption spectra, in the spectral range 300–1300 nm, indicate an increase of the optical band…

Luminescence Properties of Advanced MaterialsNuclear materials and radiation effectsMuon and positron interactions and applications

Crystal Structure of the PdxY Protein from Escherichia coli

Martin K. Safo、Faik N. Musayev、Sharyn Hunt 等 6 位作者2004-11-16Journal of Bacteriology

The crystal structure of Escherichia coli PdxY, the protein product of the pdxY gene, has been determined to a 2.2-A resolution. PdxY is a member of the ribokinase superfamily of enzymes and has sequence homology with pyridoxal kinases that phosphorylate pyridoxal at the C-5' hydroxyl. The protein is a homodimer with…

Enzyme Structure and FunctionAmino Acid Enzymes and MetabolismBiochemical and Molecular Research

Preparation and characterization of soy protein plastics plasticized with waterborne polyurethane

Niangui Wang、Lina Zhang2004-11-16Polymer International

Abstract Utilizing anionic waterborne polyurethane (WPU) as a plasticizer, for the first time, we prepared new soy protein isolate (SPI) plastics. The WPU was prepared by using the emulsion‐extending‐chain method, and mixed with soy protein in aqueous dispersion. The mixture was cast, cured, pickled and hot‐pressed to…

Nanocomposite Films for Food Packagingbiodegradable polymer synthesis and propertiesPolymer composites and self-healing

Bonding and (hyper)polarizability in the sodium dimer

George Maroulis2004-11-16The Journal of Chemical Physics

We report a conventional ab initio and density functional theory study of the polarizability (alpha(alphabeta)/e(2)a(0) (2)E(h) (-1)) and hyperpolarizability (gamma(alphabetagammadelta)/e(4)a(0) (4)E(h) (-3)) of the sodium dimer. A large [18s14p9d2f1g] basis set is thought to yield near-Hartree-Fock values for both pr…

Advanced Chemical Physics StudiesNonlinear Optical Materials ResearchInorganic Chemistry and Materials

Nano- to Macro-Sized Heterogeneities Using Cleavable Diblock Copolymers

James T. Goldbach、Kristopher A. Lavery、Jacques Penelle 等 4 位作者2004-11-16Macromolecules

Polystyrene- block -poly(methyl methacrylate) copolymers containing [4π + 4π] anthracene photodimer at the junction point between the blocks (PS-AA-PMMA) can be cleaved to the parent homopolymer blocks upon heating above 130 °C or by UV irradiation at 280 nm. PS-AA-PMMA was characterized and then used in thin films to…

Organic Electronics and PhotovoltaicsAdvanced Polymer Synthesis and CharacterizationBlock Copolymer Self-Assembly

Localized hyperpolarizability approach to the origin of nonlinear optical properties inTeO2-based materials

Shigeru Suehara、Philippe Thomas、A.P. Mirgorodsky 等 10 位作者2004-11-16Physical Review B

We present an ab initio molecular orbital theoretical approach to the origin of nonlinear optical (NLO) properties in the $\mathrm{Te}{\mathrm{O}}_{2}$-based materials from the viewpoint of ``electron pairs'' assigned to the individual chemical bond. Localized static dipole moments, linear polarizabilities, and hyperp…

Crystal Structures and PropertiesNonlinear Optical Materials ResearchSolid-state spectroscopy and crystallography