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Direct Localization of Atoms in Mixed‐Occupancy Powders by Resonant Contrast Diffraction

H. Palancher、J.-L. Hodeau、Christophe Pichon 等 7 位作者2005-02-11Angewandte Chemie International Edition

Spot on! Resonant scattering enables accurate localization of the individual cations in powders by the routine use of “anomalous differential patterns” and “dispersive difference maps” (see picture), as demonstrated for (Sr,Rb) zeolite X, a sample of potential industrial interest.

Crystal Structures and PropertiesAdvanced NMR Techniques and ApplicationsX-ray Diffraction in Crystallography

Selectivity Engineering of 2,6-Diisopropylphenol in Isopropylation of Phenol over Cs2.5H0.5PW12O40/K-10 Clay

Ganapati D. Yadav、Sanket S. Salgaonkar2005-02-11Industrial & Engineering Chemistry Research

Propofol (2,6-diisopropylphenol), a very important drug, is typically synthesized by the isopropylation of phenol over an acid catalyst. This process consists of two series reactions, namely, the formation of 2-isopropylphenol and its further isopropylation to 2,6- and 2,4-diisopropylphenols. The selectivity to 2,6-di…

Zeolite Catalysis and SynthesisMesoporous Materials and CatalysisPolyoxometalates: Synthesis and Applications

An In-Situ Synchrotron X-ray Diffraction Tomography Study of Crystallization and Preferred Crystal Orientation in a Stirred Reactor

Simon D. M. Jacques、K. Pile、P. Barnes 等 6 位作者2005-02-11Crystal Growth & Design

A new tomographic technique, based on synchrotron X-ray diffraction, has been used to chart polymorphic content and crystallite alignment inside a model pharmaceutical reactor. This reveals complex behavior according to crystallite shape/size characteristics; in particular, stirring induces pronounced crystal zonation…

Calcium Carbonate Crystallization and InhibitionCrystallization and Solubility StudiesX-ray Diffraction in Crystallography

Molecular dynamics study of the high‐temperature elasticity of SiO2 polymorphs: Structural phase transition and elastic anomaly

Hajime Kimizuka、Hideo Kaburaki2005-02-11physica status solidi (b)

Abstract The elastic properties of cristobalite and quartz, the typical polymorphs of SiO 2 , are studied with particular emphasis on the structural phase transition and the high‐temperature phase. Using the equilibrium molecular dynamics (MD) method with a stress‐fluctuation formula, we have successfully evaluated th…

High-pressure geophysics and materialsMaterial Dynamics and PropertiesGlass properties and applications

Adsorption and Reaction of Methanol on Stoichiometric and Defective SrTiO3(100) Surfaces

Li‐Qiong Wang、Kim F. Ferris、Samina Azad 等 4 位作者2005-02-11The Journal of Physical Chemistry B

The adsorption and reaction of methanol (CH(3)OH) on stoichiometric (TiO(2)-terminated) and reduced SrTiO(3)(100) surfaces have been investigated using temperature-programmed desorption (TPD), X-ray photoelectron spectroscopy (XPS), and first-principles density-functional calculations. Methanol adsorbs mostly nondisso…

Catalytic Processes in Materials ScienceMagnetic and transport properties of perovskites and related materialsElectronic and Structural Properties of Oxides

Synthesis and molecular structure analysis of nano‐sized methacryl‐grafted polysiloxane resin for fabrication of nano hybrid materials

Young‐Joo Eo、Tae Ho Lee、Se Yun Kim 等 6 位作者2005-02-11Journal of Polymer Science Part B Polymer Physics

Abstract The molecular structures of methacryl‐grafted polysiloxane resins from 3‐(trimethoxysilyl)propyl methacrylate (MPTS) and diphenylsilanediol (DPSD) were determined by theoretical computation and experimental measurement. The molecular structures obtained from theoretical computation coincided well with those f…

Polymer Nanocomposites and PropertiesSilicone and Siloxane ChemistryChemical Synthesis and Characterization

Poisson's ratio of degenerate crystalline phases of three‐dimensional hard dimers and hard cyclic trimers

Mikołaj Kowalik、Krzysztof W. Wojciechowski2005-02-11physica status solidi (b)

Abstract Monte Carlo simulations of two three‐dimensional hard‐body models, hard dimers and hard cyclic trimers, were performed in the NpT ensemble. The Poisson's ratio was determined for degenerate crystalline phases in both systems. In contrast to the results of analogous simulations in two‐dimensions, positive valu…

Phase Equilibria and ThermodynamicsMaterial Dynamics and PropertiesTheoretical and Computational Physics

High-resolution transmission electron microscopy study of the interfaces and stacking defects in superconducting/magnetic perovskite superlattices

N. Haberkorn、F.C. Lovey、A.M. Condó 等 4 位作者2005-02-11Journal of Applied Physics

We studied the microstructure of GdBa2Cu3O7−δ∕La0.6Sr0.4MnO3 superlattices grown on (001)MgO substrates by high-resolution transmission electron microscopy. The superlattices show two different epitaxial growths. In addition different types of interfaces between the layers were found. Moreover, several kinds of stacki…

Physics of Superconductivity and MagnetismFerroelectric and Piezoelectric MaterialsMagnetic and transport properties of perovskites and related materials

Self-organized growth of tetrathiafulvalene–tetracyanoquinodimethane molecular wires using the coevaporation method under a static electric field

Masatoshi Sakai、Masaaki Iizuka、Masakazu Nakamura 等 4 位作者2005-02-11Journal of Applied Physics

Wire-like crystals of tetrathiafulvalene-tetracyanoquinodimethane (TTF–TCNQ) charge-transfer complexes were grown under a static electric field by employing electric-field assisted evaporation. TTF–TCNQ molecular wires grew from the edges of two gold electrodes opposite to each other along the electric lines of force,…

Molecular Junctions and NanostructuresAdvanced battery technologies researchOrganic and Molecular Conductors Research

Angle-resolved photoemission study of the valence band structure of ZnO()

K. Ozawa、Kota Sawada、Y. Shirotori 等 4 位作者2005-02-11Journal of Physics Condensed Matter

The valence band structure of the ( ) surface of wurtzite ZnO has been investigated by angle-resolved photoelectron spectroscopy utilizing polarized synchrotron radiation. The energetic position and the dispersion width of the O 2p dangling-bond (DB) state are determined along the high symmetry axes of the surface Bri…

ZnO doping and propertiesCopper-based nanomaterials and applicationsGa2O3 and related materials

Direct Synthesis of a Bimodal Nanosponge Based on FePt and ZnS

Hongwei Gu、Rongkun Zheng、Hui Liu 等 5 位作者2005-02-11Small

More than the sum of its parts: A simple synthetic procedure yields a bimodal nanosponge based on FePt cores and ZnS branches (see picture). Sequential addition of sulfur and Zn(acac)2 into a colloidal solution of FePt nanoparticles (≈2.5 nm) provides a template-free route to a spongelike nanonetwork. Besides preservi…

Quantum Dots Synthesis And PropertiesPolymer Surface Interaction StudiesMolecular Junctions and Nanostructures

Naphthalene-1,2,3-Dithiazolyl and Its Selenium-Containing Variants

Richard T. Oakley、Robert W. Reed、Craig M. Robertson 等 4 位作者2005-02-11Inorganic Chemistry

Synthetic routes to salts of the 3H-naphtho[1,2-d][1,2,3]dithiazolylium cation and its three selenium-containing variants (SSeN, SeSN, and SeSeN) are described. The most efficient and general method involves the intermediacy of bis-acetylated aminothiolates and aminoselenolates. These reagents react smoothly with sulf…

Radical Photochemical ReactionsOrganic and Molecular Conductors ResearchSynthesis and Biological Evaluation

The evolutionary species pool hypothesis and patterns of freshwater diatom diversity along a pH gradient

Jason Pither、Lonnie W. Aarssen2005-02-11Journal of Biogeography

Abstract Aim To interpret the unimodal relationship between diatom species richness and lake pH within the context of the evolutionary species pool hypothesis (SPH). We test the following primary prediction arising from the SPH: the size of the potential species pool (PSP) will increase along a gradient representing t…

Aquatic Ecosystems and Phytoplankton DynamicsDiatoms and Algae ResearchAquatic Invertebrate Ecology and Behavior

Escherichia coli FolC Structure Reveals an Unexpected Dihydrofolate Binding Site Providing an Attractive Target for Anti-microbial Therapy

Magali Mathieu、G. Debousker、S Vincent 等 6 位作者2005-02-11Journal of Biological Chemistry

In some bacteria, such as Escherichia coli, the addition of L-glutamate to dihydropteroate (dihydrofolate synthetase activity) and the subsequent additions of L-glutamate to tetrahydrofolate (folylpolyglutamate synthetase (FPGS) activity) are catalyzed by the same enzyme, FolC. The crystal structure of E. coli FolC is…

Bacterial Genetics and BiotechnologyEnzyme Structure and FunctionBiochemical and Molecular Research

Pulse Voltammetric and ac Impedance Spectroscopic Studies on Lithium Ion Transfer at an Electrolyte/Li4/3Ti5/3O4 Electrode Interface

Takayuki Doi、Yasutoshi Iriyama、Takeshi Abe 等 4 位作者2005-02-11Analytical Chemistry

Pulse voltammetry and ac impedance spectroscopy were used to study the lithium ion kinetics at a lithium ion insertion electrode consisting of Li4/3Ti5/3O4 thin films in an organic electrolyte. In the cyclic voltammogram, two redox peaks appeared at around 1.56 V vs Li/Li+ due to the insertion and extraction of lithiu…

Conducting polymers and applicationsAdvanced Battery Technologies ResearchElectrochemical Analysis and Applications

Palladium Nanoclusters Deposited on Single-Walled Carbon Nanohorns

Elena Bekyarova、Ayako Hashimoto、Masako Yudasaka 等 9 位作者2005-02-11The Journal of Physical Chemistry B

This study reports a direct route for deposition of Pd nanoclusters on single-walled carbon nanohorns (SWNHs) in a one step reaction involving chemical reduction of metal ions in the presence of a polymer-stabilizer. The applied strategy provides small Pd nanoclusters with an average diameter of approximately 2.3 nm r…

Carbon Nanotubes in CompositesGraphene research and applicationsFullerene Chemistry and Applications

Thermal expansion and contraction of polymer thin films

Toshiji Kanaya、Tukasa Miyazaki、Rintaro Inoue 等 4 位作者2005-02-11physica status solidi (b)

Abstract We have studied thermal expansion and contraction of polystyrene thin film supported on silicon substrate using X‐ray reflectivity and inelastic neutron scattering techniques. In annealing experiments, we found fast and very slow contraction processes in the thin films above the glass transition temperature.…

Polymer crystallization and propertiesMaterial Dynamics and PropertiesTheoretical and Computational Physics

Effects of temperature, strain rate, and vacancies on tensile and fatigue behaviors of silicon-based nanotubes

Yeau‐Ren Jeng、Ping-Chi Tsai、Te‐Hua Fang2005-02-11Physical Review B

This paper adopts the Tersoff-Brenner many-body potential function to perform molecular dynamics simulations of the tensile and fatigue behaviors of hypothetical silicon-based tubular nanostructures at various temperatures, strain rates, and vacancy percentages. The tensile test results indicate that with a predicted…

Carbon Nanotubes in CompositesGraphene research and applicationsBoron and Carbon Nanomaterials Research

Tunable Photoluminescence of Closed-Shell Heterobimetallic Au−Ag Dicyanide Layered Systems

Julie Clarissa F. Colis、Christie Larochelle、Eduardo J. Fernández 等 8 位作者2005-02-11The Journal of Physical Chemistry B

The excited-state properties of the layered La[Ag(CN)(2)](3) and La[Au(CN)(2)](3) systems have been examined and compared with mixed-metal systems of varying metal ratios such as La[Ag(0.78)Au(0.22)(CN)(2)](3), La[Ag(0.55)Au(0.45)(CN)(2)](3), La[Ag(0.33)Au(0.67)(CN)(2)](3), and La[Ag(0.19)Au(0.81)(CN)(2)](3). We have…

Magnetism in coordination complexesPolyoxometalates: Synthesis and ApplicationsNanocluster Synthesis and Applications

Atomic Force Microscopy Study of the Interaction between Adsorbed Poly(ethylene oxide) Layers: Effects of Surface Modification and Approach Velocity

Scott McLean、Hadi Lioe、Laurence Meagher 等 5 位作者2005-02-11Langmuir

The interaction forces between layers of the triblock copolymer Pluronic F108 adsorbed onto hydrophobic radio frequency glow discharge (RFGD) thin film surfaces and hydrophilic silica, in polymer-free 0.15 M NaCl solution, have been measured using the atomic force microscope (AFM) colloid probe technique. Compression…

Polymer Surface Interaction StudiesForce Microscopy Techniques and ApplicationsAnalytical Chemistry and Sensors