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Ab initiocalculations for a hypothetical material: Silicon nanotubes

Solange Binotto Fagan、R. J. Baierle、R. Mota 等 5 位作者2000-04-15Physical review. B, Condensed matter

Electronic and structural properties of a hypothetical material, silicon nanotubes, are examined through first-principles calculations based on density functional theory. Even considering that Si nanotubes have never been observed, this paper attempts to establish the theoretical similarities between Si and C, like ba…

Carbon Nanotubes in CompositesGraphene research and applicationsBoron and Carbon Nanomaterials Research

Spectrally coded optical data storage by metal nanoparticles

Harald Ditlbacher、Joachim R. Krenn、Bernhard Lamprecht 等 5 位作者2000-04-15Optics Letters

In metal nanoparticles the resonance wavelength of light-driven collective electron oscillations is determined by the particle shape. This shape dependence can be used for optical data storage by spectral coding. In this way the storage density can be increased by at least a factor of 5 compared with that for conventi…

Gold and Silver Nanoparticles Synthesis and ApplicationsPhotonic and Optical DevicesNanofabrication and Lithography Techniques

General and efficient algorithms for obtaining maximally localized Wannier functions

Gerd Berghold、Christopher J. Mundy、A. Romero 等 5 位作者2000-04-15OpenAlex

Recent advances in the theory of polarization and the development of linear-scaling methods have revitalized interest in the use of Wannier functions for obtaining a localized orbital picture within a periodic supercell. To examine complex chemical systems it is imperative for the localization procedure to be efficien…

Advanced Chemical Physics StudiesAdvanced NMR Techniques and ApplicationsX-ray Diffraction in Crystallography

Quantum size effects in CuO nanoparticles

Kavita Borgohain、J.B. Singh、Mulpuri V. Rao 等 5 位作者2000-04-15OpenAlex

Size effects in cupric oxide nanocrystals, synthesized using a novel electrochemical route, having average diameters of about 4 and 6 nm, are probed by x-ray photoelectron spectroscopy. Cu---O bond ionicity was found to increase with reduction in nanocrystallite size. Formation of pure CuO phase was confirmed from x-r…

ZnO doping and propertiesCopper-based nanomaterials and applicationsElectronic and Structural Properties of Oxides

Photoalignment of Liquid-Crystal Systems

Kunihiro Ichimura2000-04-15OpenAlex

ADVERTISEMENT RETURN TO ISSUEPREVArticleNEXTPhotoalignment of Liquid-Crystal SystemsKunihiro IchimuraView Author Information Chemical Resources Laboratory, Tokyo Institute of Technology, 4259 Nagatsuta, Midori-ku, Yokohama 226-8503, Japan Cite this: Chem. Rev. 2000, 100, 5, 1847–1874Publication Date (Web):April 15, 20…

Liquid Crystal Research AdvancementsPhotonic Crystals and ApplicationsPhotochromic and Fluorescence Chemistry

Screening of antibacterial and antiparasitic activities of six Moroccan medicinal plants.

Mustapha Larhsini、L. Oumoulid、Hassan B. Lazrek 等 8 位作者2000-04-14PubMed

The extracts of six plants selected on the basis of folk-medicine reports were examined for their antibacterial effects against eight pathogenic bacteria. The results showed that n-butanol extract of Calotropis procera proved to be the most effective against the bacteria tested using the paper disc diffusion method. T…

Phytochemistry and Bioactive Compounds

Orientation of Supramolecular Self-Organized Polymeric Nanostructures by Oscillatory Shear Flow

R. Mäkinen、Janne Ruokolainen、Olli Ikkala 等 7 位作者2000-04-14Macromolecules

Macroscopic orientation of self-organized supramolecular polymeric materials has been demonstrated by oscillatory shear flow using in-situ small-angle X-ray scattering (SAXS). In the case when a homopolymer poly(4-vinylpyridine) and pentadecylphenol molecules are stoichiometrically complexed to form comb copolymer-lik…

Surfactants and Colloidal SystemsRheology and Fluid Dynamics StudiesBlock Copolymer Self-Assembly

Hydrodynamic Layer Thickness of a Polybase Brush in the Presence of Salt

Robin D. Wesley、Terence Cosgrove、Laurie Thompson 等 6 位作者2000-04-14Langmuir

A grafted weak polyelectrolyte brush has been prepared by the incorporation of one block of a diblock copolymer inside a latex particle. The preformed brush shows a maximum in its hydrodynamic layer thickness radius as a function of added salt. Beyond 0.025 M NaCl, the data can be fitted to the scaling relationship fo…

Surfactants and Colloidal SystemsPolymer Surface Interaction StudiesElectrostatics and Colloid Interactions

Solid-State 31P NMR Study of Phosphonate Binding Sites in Guanidine-Functionalized, Molecular Imprinted Silica Xerogels

Darryl Y. Sasaki、Todd M. Alam2000-04-14Chemistry of Materials

Phosphonate binding sites in guanidine and ammonium surface-functionalized silica xerogels were prepared via the molecular imprinting technique and characterized using solid-state 31 P MAS NMR. One-point, two-point, and nonspecific host−guest interactions between phenylphosphonic acid (PPA) and the functionalized gels…

Analytical chemistry methods developmentMolecular Sensors and Ion DetectionLanthanide and Transition Metal Complexes

Cylinder Alignment in Annular Structures of Microphase-Separated Polystyrene-b-Poly(methyl methacrylate)

Jong‐in Hahm、S. J. Sibener2000-04-14Langmuir

We present a novel and simple method for generating micron-scale annular structures formed from polystyrene- b -poly(methyl methacrylate) (PS- b -PMMA) diblock copolymer on a silicon oxide substrate. This method is based on prewetting of the underlying substrate with a minor polar solvent before spin-casting of the di…

Polymer Surface Interaction StudiesBlock Copolymer Self-AssemblyFluid Dynamics and Thin Films

Formation of Ultrathin Polypyrrole (PPY) Films on Alumina Particles Using Adsorbed Hexanoic Acid as a Template

Gyoujin Cho、Daniel T. Glatzhofer、B. M. Fung 等 5 位作者2000-04-14Langmuir

Thin films of polypyrrole (PPY) were deposited on alumina particles using hexanoic acid adsorbed on the particles as a template. The formation of the template on alumina was confirmed through studies of the adsorption of hexanoic acid at various pH values. The adsorption results could be fitted to the Langmuir adsorpt…

Advanced Sensor and Energy Harvesting MaterialsConducting polymers and applicationsAnalytical Chemistry and Sensors

NaY Zeolite as Host for the Selective Heterogeneous Oxidation of Silanes and Olefins with Hydrogen Peroxide Catalyzed by Methyltrioxorhenium

Waldemar Adam、Chantu R. Saha‐Möller、Oliver Weichold2000-04-14The Journal of Organic Chemistry

The methyltrioxorhenium(MTO)-catalyzed oxidation of silanes to silanols and the epoxidation of various olefins by aqueous 85% H(2)O(2) proceed in high yields and excellent product selectivities (no disiloxanes, diols) in the presence of the zeolite NaY. The oxidative species is located inside the 12-A supercages. This…

Mesoporous Materials and CatalysisPolyoxometalates: Synthesis and ApplicationsChemical Synthesis and Reactions

Synthesis and Characterization of Iron-Containing MCM-41 Porous Silica by the Exchange Method of the Template

Athanasios B. Bourlinos、Michael A. Karakassides、D. Petridis2000-04-14The Journal of Physical Chemistry B

The synthesis and characterization of iron-containing MCM-41 porous silica using the exchange method of the template with the iron salts FeCl 3 ·6H 2 O and (Fe 3 Ac 6 O·3H 2 O)NO 3 is reported. Proper conditions under which the exchange reactions can be accomplished without destroying the lattice structure of the pare…

Catalytic Processes in Materials ScienceMesoporous Materials and CatalysisPolyoxometalates: Synthesis and Applications

Dithia-Crown-Annelated Tetrathiafulvalene Disulfides: Synthesis, Electrochemistry, Self-Assembled Films, and Metal Ion Recognition

Sheng-Gao Liu、Haiying Liu、Krisanu Bandyopadhyay 等 5 位作者2000-04-14The Journal of Organic Chemistry

The synthesis and electrochemistry of a series of tetrathiafulvalene (TTF) and dithia-crown-TTF derivatives attached with one or two disulfide group(s) 7a-f are reported. The self-assembled monolayers (SAMs) of these TTF disulfides on gold were prepared and characterized by reflection-absorption infrared spectroscopy.…

Molecular Junctions and NanostructuresAnalytical Chemistry and SensorsOrganic and Molecular Conductors Research

Nanostructural Features of Pd/C Catalysts Investigated by Physical Methods: A Reference for Chemisorption Analysis

G. Fagherazzi、Patrizia Canton、Pietro Riello 等 6 位作者2000-04-14Langmuir

In this work we have determined, on a series of 0.5% Pd/C catalysts, the palladium particle sizes by the following physical techniques: (i) X-ray diffraction (XRD) line broadening (LB) method, associated with the Rietveld method, (ii) small-angle X-ray scattering, and (iii) transmission electron microscopy. The cataly…

Machine Learning in Materials Sciencenanoparticles nucleation surface interactionsX-ray Diffraction in Crystallography

X-ray Absorption Spectroscopy Studies of the Local Atomic and Electronic Structure of Iron Incorporated into Electrodeposited Hydrous Nickel Oxide Films

Mahalingam Balasubramanian、C. A. Melendres、S. M. Mini2000-04-14The Journal of Physical Chemistry B

We have utilized X-ray absorption fine structure (XAFS) spectroscopy to investigate the local atomic and electronic structure of iron incorporated into electrodeposited nickel hydroxide films. We found that cathodic codeposition from a solution containing Fe(II) and Ni(II) ions results in iron occupying Ni lattice sit…

Iron oxide chemistry and applicationsCopper-based nanomaterials and applicationsLayered Double Hydroxides Synthesis and Applications

Brownian Dynamics Simulations of Dendrimers under Shear Flow

Alexey V. Lyulin、Geoffrey R. Davies、David B. Adolf2000-04-14Macromolecules

Brownian dynamics simulations of perfect dendrimers up to the sixth generation have been performed under the influence of simple shear flow. Hydrodynamic and excluded volume interactions have been taken into account explicitly. The onset of shear-thinning is observed to occur at lower shear rates for larger dendrimers…

RNA Interference and Gene DeliveryDendrimers and Hyperbranched PolymersProtein Degradation and Inhibitors

On the Nature of Slow β-Process in Simple Glass Formers: A 2 H NMR Study

M. Vogel、E. A. Rössler2000-04-14The Journal of Physical Chemistry B

We study the dynamics of the glass formers toluene and glycerol below the glass transition temperature T g by means of 2 H NMR techniques. Whereas for toluene a slow β-process is observed in dielectric spectroscopy, this process is not discernible in glycerol. We demonstrate that standard 1D and 2D NMR experiments can…

Liquid Crystal Research AdvancementsMaterial Dynamics and PropertiesThermodynamic properties of mixtures

Light-Scattering Study of a Zwitterionic Polycarboxybetaine in Aqueous Solution

Aizhen Niu、Der‐Jang Liaw、Hui-Chuan Sang 等 4 位作者2000-04-14Macromolecules

ADVERTISEMENT RETURN TO ISSUEPREVNoteNEXTLight-Scattering Study of a Zwitterionic Polycarboxybetaine in Aqueous SolutionAizhen Niu, Der-Jang Liaw, Hui-Chuan Sang, and Chi WuView Author Information Department of Chemistry, The Chinese University of Hong Kong, Shatin, N. T., Hong Kong; Department of Chemical Engineering…

Conducting polymers and applicationsPhotochemistry and Electron Transfer StudiesLuminescence and Fluorescent Materials

Adsorption of NO on the TiO2(110) Surface: An Experimental and Theoretical Study

Dan C. Sorescu、C. N. Rusu、John T. Yates2000-04-14The Journal of Physical Chemistry B

The chemisorption properties of NO on the oxidized TiO 2 (110) surface have been investigated using both experimental and theoretical methods. The results of temperature-programmed desorption measurements indicate that for NO exposures less than 1.1 × 10 14 molecules/cm 2 NO adsorbs weakly and desorbs at ∼127 K. The t…

Catalytic Processes in Materials ScienceGas Sensing Nanomaterials and SensorsIndustrial Gas Emission Control