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Formation of Ammonia during the NO−H2 Reaction over Pt/ZrO2

Tetsuya Nanba、Frédéric Meunier、Christopher Hardacre 等 8 位作者2008-10-29The Journal of Physical Chemistry C

The mechanism for the formation of NH 3 during the NO−H 2 reaction over Pt/ZrO 2 was studied. Steady-state isotopic transient kinetic analysis was carried out with isotopic switching from 15 NO−D 2 to 14 NO−D 2, and the results revealed that formation of N 2 and N 2 O was associated with linearly adsorbed NO on the Pt…

Catalytic Processes in Materials ScienceAmmonia Synthesis and Nitrogen ReductionIndustrial Gas Emission Control

Thermal transformations in nanosized MoO3 layers

Э. П. Суровой、Н. В. Борисова2008-10-29Russian Journal of Physical Chemistry A

The degree of the transformation of MoO3 films (d= 8–130 nm) increased as the duration (1–140 min) and temperature (373–573 K) of thermal treatment grew and as the film thickness decreased under atmospheric conditions. The thermal treatment of MoO3 films decreased the optical density at λ = 350 nm and caused the appea…

Gas Sensing Nanomaterials and SensorsTransition Metal Oxide NanomaterialsPigment Synthesis and Properties

Cylindrical Domains of Block Copolymers Developed via Ordering under Moving Temperature Gradient: Real-Space Analysis

Kazuki Mita、Mikihito Takenaka、Hirokazu Hasegawa 等 4 位作者2008-10-29Macromolecules

We applied the zone heating method to cylinder-forming diblock copolymers (bcp) for controlling the orientation of the hexagonally packed cylindrical microdomain structures (hex-cyl) and reported the results of the structure analysis by small-angle X-ray scattering (SAXS) in our previous paper [Mita et al. Macromolecu…

Organic Electronics and PhotovoltaicsRheology and Fluid Dynamics StudiesBlock Copolymer Self-Assembly

Studies on structure property relationship in a polymer–clay nanocomposite film based on (PAN)8LiClO4

Abhishek Sharma、Namrata Shukla、Awalendra K. Thakur2008-10-29Journal of Polymer Science Part B Polymer Physics

Abstract A new combination of ionically conducting polymer–clay nanocomposites based on (PAN) 8 LiClO 4 + x wt % montmorillonite (unmodified) clay has been prepared using the standard solution cast process. X‐Ray diffraction (XRD) analysis reveals strong interaction of polymer salt complex (PS) with the montmorillonit…

Advanced Battery Materials and TechnologiesPolymer Nanocomposites and PropertiesConducting polymers and applications

Morphology and mechanical properties of a novel amorphous polyamide/nanoclay nanocomposite

Xingui Zhang、Leslie S. Loo2008-10-29Journal of Polymer Science Part B Polymer Physics

Abstract A novel amorphous polyamide/montmorillonite nanocomposite based on poly(hexamethylene isophthalamide) was successfully prepared by melt intercalation. Wide angle X‐ray diffraction and transmission electron microscopy showed that organoclay containing quaternary amine surfactants with phenyl and hydroxyl group…

Polymer crystallization and propertiesPolymer Nanocomposites and Propertiesbiodegradable polymer synthesis and properties

Observation of Ferroelectricity in Paramagnetic Copper Octacyanomolybdate

Kosuke Nakagawa、Hiroko Tokoro、Shin‐ichi Ohkoshi2008-10-29Inorganic Chemistry

We report the observation of ferroelectricity in a copper octacyanomolybdate-based paramagnet, Cu(2)[Mo(CN)(8)].8H(2)O (Cu(II), S = (1)/(2); Mo(IV), S = 0). This compound has a freezing point for the fixation of hydrogen bonding at 150 K. Around this temperature, an enhancement in the ferroelectricity and an increase…

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

A Novel Ni4 Complex Exhibiting Microsecond Quantum Tunneling of the Magnetization

Guillem Aromı́、Elisabeth Bouwman、Enrique Burzurı́ 等 10 位作者2008-10-29Chemistry - A European Journal

A highly asymmetric Ni(II) cluster [Ni(4)(OH)(OMe)(3)(Hphpz)(4)(MeOH)(3)](MeOH) (1) (H(2)phpz=3-methyl-5-(2-hydroxyphenyl)pyrazole) has been prepared and its structure determined by means of single-crystal X-ray diffraction by using synchrotron radiation. Variable-temperature bulk-magnetization measurements show that…

Magnetism in coordination complexesLanthanide and Transition Metal ComplexesMetal-Catalyzed Oxygenation Mechanisms

Prediction of Vibronic Coupling and Absorption Spectra of Dimers from Time-Dependent Density Functional Theory: The Case of a Stacked Streptocyanine

Julien Guthmuller、Freddy Zutterman、Benoı̂t Champagne2008-10-29Journal of Chemical Theory and Computation

Methods based on density functional theory calculations have been used to simulate the absorption spectra of a streptocyanine and of its covalently bonded dimer. Two approaches, based on multimode Franck-Condon overlap integrals, have been employed. In the first approach the monomer and the dimer are treated as single…

Porphyrin and Phthalocyanine ChemistryPhotochemistry and Electron Transfer StudiesAnalytical Chemistry and Sensors

Simultaneous feature selection and parameter optimisation using an artificial ant colony: case study of melting point prediction

Noel M. O’Boyle、David Scott Palmer、Florian Nigsch 等 4 位作者2008-10-29Chemistry Central Journal

BACKGROUND: We present a novel feature selection algorithm, Winnowing Artificial Ant Colony (WAAC), that performs simultaneous feature selection and model parameter optimisation for the development of predictive quantitative structure-property relationship (QSPR) models. The WAAC algorithm is an extension of the modif…

Computational Drug Discovery MethodsPhase Equilibria and ThermodynamicsMachine Learning in Materials Science

Influence of the compatibilizer polarity and molar mass on the morphology and the gas barrier properties of polyethylene/clay nanocomposites

Emilie Picard、A. Vermogen、J. F. Gerard 等 4 位作者2008-10-29Journal of Polymer Science Part B Polymer Physics

Abstract In this study, different modified polyethylenes with different molar masses and different modification rates were examined as compatibilizers to prepare high density polyethylene/organoclay nanocomposites. Nanocomposites having 5 wt % organo‐modified clay and 20 wt % interfacial agent were prepared by melt bl…

Polymer crystallization and propertiesPolymer Nanocomposites and PropertiesPolymer Nanocomposite Synthesis and Irradiation

p‐Type Field‐Effect Transistors of Single‐Crystal Zinc Telluride Nanobelts

Jun Zhang、Po‐Chiang Chen、Guozhen Shen 等 7 位作者2008-10-29Angewandte Chemie International Edition

Is ZnTe it great: Controlling the crystal-growth direction leads to formation of single-crystal ZnTe nanobelts along the 〈00〉 direction. The nanobelts, which were synthesized in oleylamine at 250 °C, have a narrow thickness (<6 nm). The ZnTe nanobelts behave as p-type semiconductors in field-effect transistors (see pi…

ZnO doping and propertiesQuantum Dots Synthesis And PropertiesNanowire Synthesis and Applications

Optical Phonon Lifetimes in Single-Walled Carbon Nanotubes by Time-Resolved Raman Scattering

Kwangu Kang、Taner Ozel、David G. Cahill 等 4 位作者2008-10-29Nano Letters

The lifetimes of optical phonons (OPs) in single-walled carbon nanotubes are determined by time-resolved incoherent anti-Stokes Raman scattering using a subpicosecond pump-probe method. Lifetimes in semiconducting and metallic nanotubes at room temperature are similar, 1.2 and 0.9 ps, respectively. The OP lifetimes de…

Carbon Nanotubes in CompositesDiamond and Carbon-based Materials ResearchMechanical and Optical Resonators

Synthesis of Cadmium Selenide Quantum Dots from a Non-Coordinating Solvent: Growth Kinetics and Particle Size Distribution

Jeaho Park、Kwan H. Lee、Justin F. Galloway 等 4 位作者2008-10-29The Journal of Physical Chemistry C

Here we report on the synthesis of CdSe quantum dots from a noncoordinating solvent. We show that nucleation and growth is very fast and is completed within 100 s. The subsequent increase in average particle size is due to diffusion limited coarsening. Growth and coarsening can be quenched by injection of dodecanethio…

Quantum Dots Synthesis And PropertiesChalcogenide Semiconductor Thin FilmsNanocluster Synthesis and Applications

Layers of Close-Packed Alternated Enantiomorphous Helices and the Three Different Uniplanar Orientations of Syndiotactic Polystyrene

Alexandra R. Albunia、Paola Rizzo、Oreste Tarallo 等 5 位作者2008-10-29Macromolecules

Thorough analyses of X-ray diffraction patterns of syndiotactic polystyrene (s-PS) films, exhibiting different crystalline and co-crystalline phases, and related evaluations of degrees of orientation have allowed to give a more accurate as well as simpler description of the three known uniplanar orientations. This new…

Liquid Crystal Research AdvancementsPolymer Nanocomposites and PropertiesPolymer composites and self-healing

One- and Two-Electron Reduced 1,2-Diketone Ligands in [CrIII(L•)3] (S= 0) and Na2(Et2O)2[VIV(LRed)3] (S=1/2)

Geoffrey H. Spikes、Stephen Sproules、Eckhard Bill 等 5 位作者2008-10-29Inorganic Chemistry

The electronic structures of chromium and vanadium centers coordinated by three reduced 1,2-diketones have been elucidated by using density functional theory (DFT) calculations and a host of physical methods: X-ray crystallography; cyclic voltammetry; ultraviolet-visible (UV-vis), nuclear magnetic resonance (NMR), and…

Metal complexes synthesis and propertiesMagnetism in coordination complexesMetal-Catalyzed Oxygenation Mechanisms

Pressure effects on the electron-doped highTcsuperconductor BaFe2−xCoxAs2

K. Ahilan、Jeevanantham Balasubramaniam、Fanlong Ning 等 9 位作者2008-10-29Journal of Physics Condensed Matter

Application of pressure or electron doping through Co substitution into Fe sites transforms the itinerant antiferromagnet BaFe 2 As 2 into a superconductor with T c exceeding 20 K. We carried out systematic transport measurements of BaFe 2− x Co x As 2 superconductors in pressures up to 2.5 GPa, and elucidated the int…

Corporate Taxation and AvoidanceIron-based superconductors researchIntellectual Capital and Performance Analysis

Transition Bars during Transformation of an Amorphous Calcium Carbonate Precursor

Lijun Dai、Xingguo Cheng、Laurie B. Gower2008-10-29Chemistry of Materials

A variety of calcium carbonate (CaCO 3 ) biominerals are now thought to be formed via an amorphous precursor pathway. Our group has been using in vitro model systems to examine potential crystallochemical reactions that might occur during biomineralization and, in particular, has proposed that a polymer-induced liquid…

Bone Tissue Engineering MaterialsEndodontics and Root Canal TreatmentsCalcium Carbonate Crystallization and Inhibition

Mechanism of propagation in the cationic polymerization of L,L‐lactide

Małgorzata Baśko、Przemysław Kubisa2008-10-29Journal of Polymer Science Part A Polymer Chemistry

Cationic ring-opening polymerization of oxygen-containing heterocycles may proceed either by active chain end (ACE) mechanism or by activated monomer (AM) mechanism for which the presence of terminal HO group is required. Typically, ACE mechanism is favored. Cationic polymerization of L,L-lactide seems to be an excep…

Advanced Polymer Synthesis and Characterizationbiodegradable polymer synthesis and propertiesCarbon dioxide utilization in catalysis

Low-temperature structure of magnetite studied using resonant x-ray scattering

Yves Joly、J. E. Lorenzo、E. S. Nazarenko 等 6 位作者2008-10-29Physical Review B

We propose a model for the Fe atomic displacements in the low-temperature phase of magnetite $({\text{Fe}}_{3}{\text{O}}_{4})$, based on the analysis of the photon energy dependence of the scattered intensity of selected reflections in a resonant x-ray scattering experiment. The symmetry of the displacement pattern is…

Magnetic Properties and Synthesis of FerritesIron oxide chemistry and applicationsX-ray Diffraction in Crystallography

Bifunctional dithiocarbamates: a bridge between coordination chemistry and nanoscale materials

E.R. Knight、A.R. Cowley、Graeme Hogarth 等 4 位作者2008-10-29Dalton Transactions

A dithiocarbamate-based methodology is employed to prepare linked heteromultimetallic complexes and then further exploited in the surface functionalisation of gold nanoparticles.

Gold and Silver Nanoparticles Synthesis and ApplicationsDendrimers and Hyperbranched PolymersNanocluster Synthesis and Applications