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Superconductivity near the vibrational-mode instability inMgCNi3

Alexander Ignatov、Sergey Y. Savrasov、Trevor A. Tyson2003-12-23Physical review. B, Condensed matter

To understand the role of electron-phonon interaction in superconducting ${\mathrm{MgCNi}}_{3}$ we have performed density-functional based linear response calculations of its lattice dynamical properties. A large coupling constant $\ensuremath{\lambda}=1.51$ is predicted and contributing phonons are identified as disp…

Ferroelectric and Piezoelectric MaterialsSuperconductivity in MgB2 and AlloysThermal Expansion and Ionic Conductivity

Deep hydrogen traps in heavily B-doped diamond

J. P. Goss、P. R. Briddon、R. Jones 等 9 位作者2003-12-23Physical review. B, Condensed matter

Exposure of heavily B-doped $(2\ifmmode\times\else\texttimes\fi{}{10}^{19}--4\ifmmode\times\else\texttimes\fi{}{10}^{20}{\mathrm{cm}}^{\ensuremath{-}3})$ diamond to a deuterium plasma results in the formation of passive B-D complexes which are bound with a dissociation barrier of 2.5 eV. In heavily doped material ther…

Metal and Thin Film MechanicsHigh-pressure geophysics and materialsDiamond and Carbon-based Materials Research

New Approaches for Synthesizing γIII-CoOOH by Soft Chemistry

Fanny Bardé、M. Rosa Palacín、B. Beaudoin 等 5 位作者2003-12-23Chemistry of Materials

Two soft chemical processes enabling the low-temperature synthesis of γIII-CoOOH are reported. Both processes consist of an oxidation reaction of αII-Co(OH) 2 performed either in dry conditions (ozonation) or in solution. The γIII-CoOOH phase is usually prepared using a ceramic step process, which hinders its synthesi…

Electrocatalysts for Energy ConversionCatalytic Processes in Materials ScienceTransition Metal Oxide Nanomaterials

Magnetic and magnetotransport properties of Fe2P nanocrystallites via a solvothermal route

Feng Luo、Huilan Su、Wei Song 等 6 位作者2003-12-23Journal of Materials Chemistry

Hexagonal nanocrystalline Fe2P has been synthesized via a solvothermal route at a relatively low temperature of 180 °C. X-Ray diffraction (XRD), X-ray photoelectron spectra (XPS) and transmission electron microscopy (TEM) were used to investigate the phase, composition, and morphology of the final crystallized product…

Magnetic properties of thin filmsIron-based superconductors researchMagnetic Properties of Alloys

Direct Sol−Gel Replication without Catalyst in an Aqueous Gel System: From a Lipid Nanotube with a Single Bilayer Wall to a Uniform Silica Hollow Cylinder with an Ultrathin Wall

Qingmin Ji、Rika Iwaura、Masaki Kogiso 等 6 位作者2003-12-23Chemistry of Materials

A combination of transmission electron microscopy (TEM) and atomic force microscopy (AFM) revealed that a secondary ammonium hydrochloride of a peptidic lipid, in which an l -prolyl- l -prolyl- l -proline fragment is coupled with an l -glutamate derivative carrying two long alkyl chains, self-assembles in water to for…

Mesoporous Materials and CatalysisPorphyrin and Phthalocyanine ChemistrySupramolecular Self-Assembly in Materials

Molecular Paramagnetic Semiconductor: Crystal Structures and Magnetic and Conducting Properties of the Ni(dmit)2 Salts of 6-Oxoverdazyl Radical Cations (dmit = 1,3-Dithiol-2-thione-4,5-dithiolate)

Kazuo Mukai、N. Senba、Tsubasa Hatanaka 等 10 位作者2003-12-23Inorganic Chemistry

Four kinds of 1:1 and 1:3 salts of 3-[4-(trimethylammonio)phenyl]-1,5-diphenyl-6-oxoverdazyl radical cation ([1](+)) and its mono- and dimethyl derivatives ([2](+) and [3](+)) with Ni(dmit)(2) anions (dmit = 1,3-dithiol-2-thione-4,5-dithiolate) ([1](+)[Ni(dmit)(2)](-) (4), [2](+)[Ni(dmit)(2)](-) (5), [3](+)[Ni(dmit)(2…

Perovskite Materials and ApplicationsMagnetism in coordination complexesOrganic and Molecular Conductors Research

Modeling of Lipase Catalyzed Ring-Opening Polymerization of ε-Caprolactone

G. Sivalingam、Giridhar Madras2003-12-23Biomacromolecules

Enzymatic ring-opening polymerization of epsilon-caprolactone by various lipases was investigated in toluene at various temperatures. The determination of molecular weight and structural identification was carried out with gel permeation chromatography and proton NMR, respectively. Among the various lipases employed,…

Enzyme Catalysis and Immobilizationbiodegradable polymer synthesis and propertiesCatalysis for Biomass Conversion

Structural, NMR, and EPR Studies of S = 1/2 and S = 3/2 Fe(III) Bis(4-Cyanopyridine) Complexes of Dodecasubstituted Porphyrins

Liliya A. Yatsunyk、F. Ann Walker2003-12-23Inorganic Chemistry

The NMR and EPR spectra for three complexes, iron(III) octamethyltetraphenylporphyrin bis(4-cyanopyridine) perchlorate, [FeOMTPP(4-CNPy)(2)]ClO(4), and its octaethyl- and tetra-beta,beta'-tetramethylenetetraphenylporphyrin analogues, [FeOETPP(4-CNPy)(2)]ClO(4) and [FeTC(6)TPP(4-CNPy)(2)]ClO(4), are presented. The crys…

Magnetism in coordination complexesPorphyrin and Phthalocyanine ChemistryMetal-Catalyzed Oxygenation Mechanisms

New Mixed Alkali Effect in the ac Conductivity of Ion-Conducting Glasses

Cornelia Cramer、Sabine Brunklaus、Eva‐Maria Ratai 等 4 位作者2003-12-23Physical Review Letters

We have determined the first wide-range conductivity spectra of a mixed alkali glass system, extending from 10(-3) Hz to 1.3 THz. We report on a new mixed alkali effect in the ac conductivity that is evident even if the low-frequency contributions (linked to hopping motions of the mobile cations) are removed from the…

Material Dynamics and PropertiesGlass properties and applicationsPhase-change materials and chalcogenides

Size Control, Metal Substitution, and Catalytic Application of Cryptomelane Nanomaterials Prepared Using Cross-linking Reagents

Jia Liu、Young‐Chan Son、Jun Cai 等 6 位作者2003-12-23Chemistry of Materials

A novel sol−gel-assisted solid-state synthetic method has been developed to prepare pure and transition-metal-substituted cryptomelane 1D nanomaterials with controlled particle sizes. Different cross-linking reagents (PVA, glycerol, or glucose) have been used to prepare precursor powder materials and to produce nanoro…

Catalytic Processes in Materials ScienceQuantum Dots Synthesis And PropertiesThermal and Kinetic Analysis

Magnetism in dense hexagonal iron

Gerd Steinle‐Neumann、Lars Stixrude、R. E. Cohen2003-12-23Proceedings of the National Academy of Sciences

The magnetic state of hexagonal close-packed iron has been the subject of debate for more than three decades. Although Mössbauer measurements find no evidence of the hyperfine splitting that can signal the presence of magnetic moments, density functional theory predicts an antiferromagnetic (afm) ground state. This di…

Rare-earth and actinide compoundsAdvanced Condensed Matter PhysicsIron-based superconductors research

Hydrogen Storage in Graphite Nanofibers: Effect of Synthesis Catalyst and Pretreatment Conditions

Angela D. Lueking、Ralph T. Yang、N.M. Rodríguez 等 4 位作者2003-12-23Langmuir

A series of graphite nanofibers (GNFs) that were subjected to various pretreatments were used to determine how modifications in the carbon structure formed during either synthesis or pretreatment steps results in active or inactive materials for hydrogen storage. The nanofibers possessing a herringbone structure and a…

Advancements in Battery MaterialsSupercapacitor Materials and FabricationHydrogen Storage and Materials

The galactokinase of Hypocrea jecorina is essential for cellulase induction by lactose but dispensable for growth on d‐galactose

Bernhard Seiboth、Lukas Hartl、Manuela Pail 等 6 位作者2003-12-23Molecular Microbiology

Lactose is the only soluble carbon source which can be used economically for the production of cellulases or heterologous proteins under cellulase expression signals by Hypocrea jecorina (=Trichoderma reesei). Towards an understanding of lactose metabolism and its role in cellulase formation, we have cloned and charac…

Enzyme Structure and FunctionPolyamine Metabolism and ApplicationsAmino Acid Enzymes and Metabolism

Atomistic study of dopant site-selectivity and defect association in the lanthanum gallate perovskite

M. Saiful Islam、R. Andrew Davies2003-12-23Journal of Materials Chemistry

Advanced modelling techniques have been used to investigate the defect properties of the LaGaO3 ionic conductor on the atomic-scale. The present study addresses a variety of topics, but focuses on the site-selectivity of a wide range of dopants, the influence of A-site deficiency, the nature of dopant–vacancy associat…

Advancements in Solid Oxide Fuel CellsLayered Double Hydroxides Synthesis and ApplicationsMicrowave Dielectric Ceramics Synthesis

Gas Transport Characteristics through a Carbon Nanotubule

Sarah M. Cooper、Brett A. Cruden、M. Meyyappan 等 5 位作者2003-12-23Nano Letters

We report the first determination of the slip coefficient for tubular carbon structures that have been produced by chemical vapor deposition on a porous alumina substrate with nominal pore diameters of 200 nm. A uniform 20−30 nm thick carbonaceous coating was formed over the pores. The permeability of the porous alumi…

Advanced ceramic materials synthesisNanopore and Nanochannel Transport StudiesAnodic Oxide Films and Nanostructures

A Side-Chain Dendronized Nonlinear Optical Polyimide with Large and Thermally Stable Electrooptic Activity

Jingdong Luo、Marnie Haller、Hongxiang Li 等 8 位作者2003-12-23Macromolecules

Organic second-order nonlinear optical (NLO) materi-als have received increasing interests due to their potential applications in high-speed electrooptic (E-O) devices with very broad bandwidth (up to 150 GHz) and low driving voltages (<1 V).1 In the pursuit of a new generation of highly efficient NLO polymers…

Liquid Crystal Research AdvancementsNonlinear Optical Materials ResearchDendrimers and Hyperbranched Polymers

A New Postfunctional Approach To Prepare Second-Order Nonlinear Optical Polyphophazenes Containing Sulfonyl-Based Chromophore

Zhen Li、Cheng Huang、Jianli Hua 等 6 位作者2003-12-23Macromolecules

A new synthetic strategy was developed to prepare polyphosphazenes with second-order nonlinear optical chromophore in which sulfonyl groups are the acceptors. Thus, polyphosphazenes P1 and P2 that contain aniline or indole groups as side chains were obtained from a highly reactive macromolecular intermediate, poly(dic…

Nonlinear Optical Materials ResearchPhotorefractive and Nonlinear OpticsSynthesis and Properties of Aromatic Compounds

Low Surface Energy Polymeric Films from Novel Fluorinated Blocked Isocyanates

Luc van Ravenstein、W. Ming、R.D. van de Grampel 等 8 位作者2003-12-23Macromolecules

Polymeric films with surface energies as low as 10 mN/m were prepared from a mixture of a hydroxyl-end-capped solventless liquid oligoester (SLO), a blocked polyisocyanate, and a novel fluorinated blocked isocyanate (F n B-NCO; the ratio of the fluorinated tail and the caprolactam blocking group: 1:1), with less than…

Surface Modification and SuperhydrophobicityAdvanced Sensor and Energy Harvesting MaterialsFiber-reinforced polymer composites

Synthesis of Platinum Nanowires in Organic−Inorganic Mesoporous Silica Templates by Photoreduction: Formation Mechanism and Isolation

Yuzuru Sakamoto、Atsushi Fukuoka、Takanori Higuchi 等 6 位作者2003-12-23The Journal of Physical Chemistry B

Pt nanowires are synthesized in organic−inorganic mesoporous silica HMM-1 (channel diameter 3 nm) by photoreduction, and the formation mechanism and isolation of the wires have been studied. UV-irradiation of HMM-1 impregnated with H 2 PtCl 6 for 48 h in the presence of adsorbed water and methanol leads to the formati…

Catalytic Processes in Materials ScienceMesoporous Materials and CatalysisSurface Chemistry and Catalysis

Interfacial elasticity and coalescence suppression in compatibilized polymer blends

Ellen Van Hemelrijck、Peter Van Puyvelde、Sachin Velankar 等 5 位作者2003-12-23Journal of Rheology

Shear-induced coalescence was studied in immiscible blends of polydimethylsiloxane ~PDMS! and polyisoprene ~PI! with a droplet-matrix morphology, using both rheology and scanning electron microscopy. Dynamic moduli of the blends compatibilized with different amounts of a PDMS–PI diblock were measured. The experimental…

Polymer crystallization and propertiesPolymer Nanocomposites and PropertiesRheology and Fluid Dynamics Studies