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A Connection between Empirical Bond Strength and the Localization of the Electron Density at the Bond Critical Points of the SiO Bonds in Silicates

G. V. Gibbs、David F. Cox、K. M. Rosso2004-08-25The Journal of Physical Chemistry A

The empirical bond strength of the SiO bond correlates with the value of the electron density at the bond critical point calculated for a large number of silicates and observed for the silica polymorphs stishovite and coesite. The greater the bond strength, the greater the localization of the electron density at the c…

Zeolite Catalysis and SynthesisGlass properties and applicationsCrystal Structures and Properties

Scaling in polyelectrolyte networks

Bernward A. Mann、Ralf Everaers、Christian Holm 等 4 位作者2004-08-25Europhysics Letters (EPL)

Using scaling arguments, the equilibrium swelling behaviour of a cross-linked polyelectrolyte gel has been investigated by means of molecular-dynamics simulations of a coarse-grained model; a bead-spring defect-free network with diamond-like topology was considered at the θ-point and under good solvent conditions, whe…

Material Dynamics and PropertiesSurfactants and Colloidal SystemsElectrostatics and Colloid Interactions

High‐Density Polyethylene Micro‐ and Nanocomposites: Effect of Particle Shape, Size and Surface Treatment on Polymer Crystallinity and Gas Permeability

Maged A. Osman、Ayman Atallah2004-08-25Macromolecular Rapid Communications

Abstract Summary: High‐density polyethylene (HDPE) micro‐ and nanocomposites with spherical and platelike inclusions were prepared and the effect of filler particles on polymer crystallinity and gas permeability was investigated. Platelike inclusions strongly reduce the polymer permeability coefficient, while spherica…

Polymer crystallization and propertiesPolymer Nanocomposites and PropertiesPolymer Nanocomposite Synthesis and Irradiation

Independence of the relaxation of a supercooled fluid from its microscopic dynamics: Need for yet another extension of the mode-coupling theory

Grzegorz Szamel、Elijah Flenner2004-08-25Europhysics Letters (EPL)

Using Brownian dynamics computer simulations, we show that the relaxation of a supercooled Brownian system is qualitatively the same as that of a Newtonian system. In particular, near the so-called mode-coupling transition temperature, dynamic properties of the Brownian system exhibit the same deviations from power la…

Material Dynamics and PropertiesTheoretical and Computational PhysicsAdvanced Thermodynamics and Statistical Mechanics

Specific Antitumor Targetable β-Cyclodextrin−Poly(ethylene Glycol)−Folic Acid Drug Delivery Bioconjugate

Stefano Salmaso、Alessandra Semenzato、Paolo Caliceti 等 7 位作者2004-08-25Bioconjugate Chemistry

The tumor targeting properties of a new drug carrier synthesized by bioconjugation of folic acid (FA) to beta-cyclodextrins through a poly(ethylene glycol) (PEG) spacer (CD-PEG-FA) were investigated. Surface plasmon resonance demonstrated that CD-PEG-FA specifically interacts with immobilized folate binding protein (F…

Nanoparticle-Based Drug DeliveryDrug Solubulity and Delivery SystemsPharmaceutical studies and practices

A New Generation of Highly Branched Polymers: Hyperbranched, Segmented Poly(urethane urea) Elastomers

Serkan Ünal、İskender Yılgör、Emel Yılgör 等 6 位作者2004-08-25Macromolecules

ADVERTISEMENT RETURN TO ISSUEPREVCommunication to the...Communication to the EditorNEXTA New Generation of Highly Branched Polymers: Hyperbranched, Segmented Poly(urethane urea) ElastomersS. Unal, I. Yilgor, E. Yilgor, J. P. Sheth, G. L. Wilkes, and T. E. LongView Author Information Department of Chemistry, Virginia P…

Advanced Polymer Synthesis and CharacterizationDendrimers and Hyperbranched PolymersSynthesis and properties of polymers

Direct Observation of Large Electronic Domains with Memory Effect in Doped Manganites

D. D. Sarma、D. Topwal、Unnikrishnan Manju 等 11 位作者2004-08-25Physical Review Letters

We use a spatially resolved, direct spectroscopic probe for electronic structure with an additional sensitivity to chemical compositions to investigate high-quality single crystal samples of La(1/4)Pr(3/8)Ca(3/8)MnO3, establishing the formation of distinct insulating domains embedded in the metallic host at low temper…

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

A Novel, Facile Method for the Preparation of Uniform, Reactive Maleic Anhydride/Vinyl Acetate Copolymer Micro‐ and Nanospheres

Changmin Xing、Wantai Yang2004-08-25Macromolecular Rapid Communications

Abstract Summary: A novel, stabilizer‐free dispersion polymerization with alkyl esters as reaction media gives uniform alternating microspheres of maleic anhydride (MAn)/vinyl acetate (VAc) copolymer. The diameter of the copolymer microspheres could be precisely controlled from 80 to 750 nm by changing the monomer con…

Advanced Polymer Synthesis and CharacterizationDendrimers and Hyperbranched PolymersSynthesis and properties of polymers

Artificial Cells: Temperature‐Dependent, Reversible Li+‐Ion Uptake/Release Equilibrium at Metal Oxide Nanocontainer Pores

Achim Müller、Dieter Rehder、Erhard T. K. Haupt 等 7 位作者2004-08-25Angewandte Chemie International Edition

Lithium ion trafficking: Surprisingly stable and soluble spherical molybdenum oxide based porous nanocontainers/artificial cells (see graphic) interact specifically with their environment, for example, with cations abundant in solution, to incorporate them at well-defined internal cell positions. In the present case,…

Electrochemical sensors and biosensorsConducting polymers and applicationsPolyoxometalates: Synthesis and Applications

Pattern coarsening in a 2D hexagonal system

Christopher Harrison、Dan Angelescu、M Trawick 等 10 位作者2004-08-25Europhysics Letters (EPL)

We have studied the ordering dynamics of a two-dimensional system which consists of a single layer of spherical block copolymer microdomains in a thin film. We follow the annealing process after a quench from the disordered state by electron microscopy and time-lapse atomic force microscopy. At late times the orientat…

Theoretical and Computational PhysicsForce Microscopy Techniques and ApplicationsBlock Copolymer Self-Assembly

Diruthenium Tetraacetate Monocation, [RuII/III2(O2CMe)4]+, Building Blocks for 3-D Molecule-Based Magnets

T.E. Vos、Yi Liao、William W. Shum 等 7 位作者2004-08-25Journal of the American Chemical Society

Diruthenium tetracarboxylates monocations are utilized as building blocks for cubic 3-D network structured molecule-based magnets. [Ru(II/III)(2)(O(2)CMe)(4)](3)[M(III)(CN)(6)] [M = Cr (1a), Fe (2), Co (3)] were prepared in aqueous solution. Powder X-ray diffraction indicates that they have body-centered cubic structu…

Magnetism in coordination complexesLanthanide and Transition Metal ComplexesOrganic and Molecular Conductors Research

Spontaneous Formation of Hierarchical Macro−Mesoporous Ethane−Silica Monolith

Kazuki Nakanishi、Yuki Kobayashi、Tomohiko Amatani 等 5 位作者2004-08-25Chemistry of Materials

Monolithic ethane−silica gels with well-defined co-continuous macropores and highly ordered mesopores have been synthesized via a spontaneous route from silicon alkoxide with the aid of a structure-directing agent. While the macropores are formed by the concurrent phase separation and sol−gel transition induced by the…

Mesoporous Materials and CatalysisCatalysis and Oxidation ReactionsAerogels and thermal insulation

Surface‐enhanced Raman scattering study of the adsorption of the anthraquinone pigment alizarin on Ag nanoparticles

María Vega Cañamares、José Vicente García‐Ramos、Concepción Domingo 等 4 位作者2004-08-25Journal of Raman Spectroscopy

Abstract FT‐Raman and surface‐enhanced Raman scattering (SERS) spectroscopy were applied in the vibrational characterization and study of the adsorption and acidity behavior of the highly fluorescent anthraquinone dye alizarin on Ag colloids prepared by chemical reduction with hydroxylamine hydrochloride. The SERS spe…

Gold and Silver Nanoparticles Synthesis and Applicationsmelanin and skin pigmentationDye analysis and toxicity

Molecular Weight Dependence of Phase Structures and Transitions of Mesogen-Jacketed Liquid Crystalline Polymers Based on 2-Vinylterephthalic Acids

Chun Ye、Hailiang Zhang、Yun Huang 等 10 位作者2004-08-25Macromolecules

The phase structures and transition behaviors of a series of mesogen-jacketed liquid crystalline (LC) polymers, poly{2,5-bis[(4-methoxyphenyl)oxycarbonyl]styrenes} (PMPCS), with different molecular weights (MW) and narrow MW distributions were studied using differential scanning calorimetry, polarized light microscopy…

Liquid Crystal Research AdvancementsAdvanced Polymer Synthesis and CharacterizationSurfactants and Colloidal Systems

Catalytic Growth of Au Nanoparticles by NAD(P)H Cofactors: Optical Sensors for NAD(P)+‐Dependent Biocatalyzed Transformations

Yi Xiao、Valeri Pavlov、Semion Levine 等 6 位作者2004-08-25Angewandte Chemie International Edition

Gold-plated gold: NAD(P)H cofactors mediate the catalytic growth of Au nanoparticles in the presence of AuCl4− and CTAB (cetyltrimethylammonium bromide; see picture). The process allows for the optical detection of the cofactors and the analysis of NAD(P)+-dependent biocatalyzed transformations in solutions and on sur…

Advanced biosensing and bioanalysis techniquesNanocluster Synthesis and ApplicationsAdvanced Nanomaterials in Catalysis

Total energy calculation of high pressure selenium: The origin of incommensurate modulations in Se-IV and the instability of proposed Se-II

G. J. Ackland、H. Fox2004-08-25arXiv

We present calculation of the high pressure crystal structures in selenium, including rational approximants to the recently reported incommensurate phases. We show how the incommensurate phases can be intuitively explained in terms of imaginary phonon frequencies arising from Kohn anomalies in the putative undistorted…

Materials Sciencecond-mat.other

Structures of Si and Ge nanowires in the sub-nanometer range

Ricardo Kagimura、Ricardo W. Nunes、Helio Chacham2004-08-25arXiv

We report an ab-initio investigation of several possible Si and Ge pristine nanowires with diameters between 0.5 and 1.2 nm. We considered nanowires based on the diamond structure, high-density bulk structures, and fullerene-like structures. We find that the diamond structure nanowires are unstable for diameters small…

Materials Science

From Discrete Hopping to Continuum Modeling on Vicinal Surfaces with Applications to Si(001) Electromigration

T. Zhao、J. D. Weeks、D. Kandel2004-08-25arXiv

Coarse-grained modeling of dynamics on vicinal surfaces concentrates on the diffusion of adatoms on terraces with boundary conditions at sharp steps, as first studied by Burton, Cabrera and Frank (BCF). Recent electromigration experiments on vicinal Si surfaces suggest the need for more general boundary conditions in…

Materials Sciencecond-mat.stat-mech

Currents, Torques, and Polarization Factors in Magnetic Tunnel Junctions

J. Slonczewski2004-08-25arXiv

Application of Bardeen's tunneling theory to magnetic tunnel junctions having a general degree of atomic disorder reveals the close relationship between magneto-conduction and voltage-driven pseudo-torque, as well as the thickness dependence of tunnel-polarization factors. Among the results: 1) The torque generally va…

Mesoscale and Nanoscale PhysicsMaterials Science