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Electronic structure, phonons and electron–phonon interaction in MgXNi3(X = B, C and N)

H. M. Tütüncü、G. P. Srivastava2006-11-21Journal of Physics Condensed Matter

Ab initio calculations have been performed to study the electronic structure, phonon dispersion relations, and the electron–phonon interaction for cubic superconductors MgXNi 3 with X = B, C and N. The electronic calculations are based upon the application of a plane wave basis, ultrasoft pseudopotentials, and the loc…

Rare-earth and actinide compoundsSuperconductivity in MgB2 and AlloysThermal Expansion and Ionic Conductivity

Ab initioelectronic structure and magnetism in Sr2XMoO6(X = Fe or Co) double perovskite systems: a GGA and GGA+Ucomparative study

D. Stoeffler、Corina Etz2006-11-21Journal of Physics Condensed Matter

Using the full potential linearized augmented plane wave ab initio method, we investigate bulk magnetic properties of Sr2XMoO6 (X = Fe, Co) double perovskites by comparing the results obtained with the generalized gradient approximation (GGA) and GGA+U methods in order to discuss their magnetic configuration in relati…

Magnetic and transport properties of perovskites and related materialsAdvanced Condensed Matter PhysicsThermal Expansion and Ionic Conductivity

Insertion of Magnetic Bimetallic Oxalate Complexes into Layered Double Hydroxides

Eugenio Coronado、José Ramón Galán‐Mascarós、Carlos Martí‐Gastaldo 等 4 位作者2006-11-21Chemistry of Materials

Bimetallic oxalate complexes have been successfully inserted into layered double hydroxides as ferromagnetic oxalate-bridged oligomers. Different preparation methods afford different sizes and compositions for the oligomers. In all cases, no magnetic ordering has been observed above 2 K.

Mesoporous Materials and CatalysisPolyoxometalates: Synthesis and ApplicationsLayered Double Hydroxides Synthesis and Applications

Thermal Behavior, Structure and Morphology of Propene/Higher 1-Olefin Copolymers

Paola Stagnaro、Giovanna Costa、V. Trefiletti 等 6 位作者2006-11-21Macromolecular Chemistry and Physics

Summary: Propene-based random copolymers, synthesized with two isospecific methylaluminoxane-activated ansa-zirconocenes and containing even and odd carbon-numbered higher 1-olefins, were investigated by DSC and WAXD. Nature and amount of co-units affect primary and secondary crystallization as well as melting behavio…

Polymer crystallization and propertiesPolymer Nanocomposites and Propertiesbiodegradable polymer synthesis and properties

Photochemical synthesis of crown-shaped platinum nanoparticles using aggregates of G4-NH 2 PAMAM dendrimer as templates

Xuzhong Luo、Toyoko Imae2006-11-21Journal of Materials Chemistry

Crown-shaped platinum nanoparticles were synthesized by UV irradiation in the presence of G4-NH2 PAMAM dendrimers in water. Aggregates of the dendrimers, which were formed in the aqueous solution, served as templates for the formation of such nonspherical nanoparticles. This is the first report on the preparation of s…

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

Layer‐by‐layer assembly of polyelectrolyte films improving cytocompatibility to neural cells

Zhong‐Rong Wu、Jun Ma、Bingfang Liu 等 5 位作者2006-11-21Journal of Biomedical Materials Research Part A

The using of layer-by-layer assembly polyelectrolyte (PE) films has been suggested as a new versatile technique for surface modification aimed at tissue engineering and cell-based chips. In this study, we investigated the surface morphology of the hyaluronic acid (HA)-based PE films deposited on the amino-functionaliz…

Hydrogels: synthesis, properties, applicationsElectrospun Nanofibers in Biomedical ApplicationsPolymer Surface Interaction Studies

Flow transitions in two-dimensional foams

C. N. Gilbreth、Scott T. Sullivan、Michael Dennin2006-11-21Physical Review E

For sufficiently slow rates of strain, flowing foam can exhibit inhomogeneous flows. The nature of these flows is an area of active study in both two-dimensional model foams and three dimensional foam. Recent work in three-dimensional foam has identified three distinct regimes of flow [S. Rodts, J. C. Baudez, and P. C…

Geological formations and processesAdvanced Neuroimaging Techniques and ApplicationsPickering emulsions and particle stabilization

Self‐Catalysis of Phthaloylchitosan for Graft Copolymerization of ε‐Caprolactone with Chitosan

Li Liu、Liuxi Chen、Yue'e Fang2006-11-21Macromolecular Rapid Communications

Abstract Summary: A protection‐graft‐deprotection method was developed to prepare chitosan‐ g ‐polycaprolactone graft copolymers, during which the ring‐opening copolymerization of ε ‐caprolactone onto phthaloylchitosan (PHCS) happened without any additional catalysis. The intermediate PHCS was introduced primarily to…

Advanced Polymer Synthesis and Characterizationbiodegradable polymer synthesis and propertiesPolyoxometalates: Synthesis and Applications

Critical exponents and amplitudes of the ferromagnetic transition inLa0.1Ba0.9VS3

Riccardo Cabassi、F. Bolzoni、Andrea Gauzzi 等 4 位作者2006-11-21Physical Review B

To study the origin of the magnetic transition in $\mathrm{Ba}\mathrm{V}{\mathrm{S}}_{3}$, we measured the dc magnetization on ${\mathrm{La}}_{0.1}{\mathrm{Ba}}_{0.9}\mathrm{V}{\mathrm{S}}_{3}$ sintered samples near the ferromagnetic transition. Effective critical exponents and amplitudes are obtained by means of stan…

High-pressure geophysics and materialsMagnetic and transport properties of perovskites and related materialsAdvanced Condensed Matter Physics

Infrared and Raman spectra of silica polymorphs from an ab initio parametrized polarizable force field

Yunfeng Liang、Caetano R. Miranda、Sandro Scandolo2006-11-21The Journal of Chemical Physics

The general aim of this study is to test the reliability of polarizable model potentials for the prediction of vibrational (infrared and Raman) spectra in highly anharmonic systems such as high temperature crystalline phases. By using an ab initio parametrized interatomic potential for SiO2 and molecular dynamics simu…

High-pressure geophysics and materialsGlass properties and applicationsSolid-state spectroscopy and crystallography

Slip, Yield, and Bands in Colloidal Crystals under Oscillatory Shear

Itai Cohen、Benny Davidovitch、Andrew B. Schofield 等 5 位作者2006-11-21Physical Review Letters

We study dense colloidal crystals under oscillatory shear using a confocal microscope. At large strains the crystals yield and the suspensions form shear bands. The pure harmonic response exhibited by the suspension rules out the applicability of nonlinear rheology models typically used to describe shear banding in ot…

Material Dynamics and PropertiesSurfactants and Colloidal SystemsRheology and Fluid Dynamics Studies

Supra-Assembly of Siliceous Vesicles

Hongning Wang、Xufeng Zhou、Meihua Yu 等 10 位作者2006-11-21Journal of the American Chemical Society

We report a new approach to produce macroporous ( approximately 110 nm in diameter) ordered siliceous foams (MOSF) by using block copolymers as templates in the absence of any organic cosolvent. The fine three-dimensional honeycomb structure of MOSF was determined by electron tomography. A formation mechanism of MOSF…

Zeolite Catalysis and SynthesisMesoporous Materials and CatalysisDiatoms and Algae Research

The True Johari−Goldstein β-Relaxation of Monosaccharides

Kamil Kamiński、Ewa Kamińska、Marian Paluch 等 5 位作者2006-11-21The Journal of Physical Chemistry B

Broadband isothermal dielectric relaxation measurements of anhydrous fructose, glucose, galactose, sorbose, and ribose were made at ambient pressure in their liquidus and glassy states. We found a new secondary relaxation in fructose and glucose that is slower than those seen before by others. This new secondary relax…

Material Dynamics and PropertiesThermodynamic properties of mixturesSpectroscopy and Quantum Chemical Studies

Dielectric constants of Ir, Ru, Pt, and IrO 2 : Contributions from bound charges

Woo Seok Choi、S. S. A. Seo、K. W. Kim 等 6 位作者2006-11-21Physical Review B

We investigated the dielectric functions $\stackrel{\fontencoding{LECO}\selectfont\char177{}}{\ensuremath{\epsilon}}(\ensuremath{\omega})$ of Ir, Ru, Pt, and ${\mathrm{IrO}}_{2}$, which are commonly used as electrodes in ferroelectric thin-film applications. In particular, we investigated the contributions from bound…

Ferroelectric and Piezoelectric MaterialsPhotorefractive and Nonlinear OpticsAcoustic Wave Resonator Technologies

Fabrication of Polyaniline Nanostructures under Ultrasonic Irradiation: From Nanotubes to Nanofibers

Xiaofeng Lu、Hui Mao、Danming Chao 等 5 位作者2006-11-21Macromolecular Chemistry and Physics

Abstract Summary: An ultrasonic irradiation assisted polymerization method has been used to prepare PANI nanotubes and nanofibers by using different doping concentrations of mineral or organic acids. It has been found that PANI nanotubes can be produced when the concentration of the dopant acid is low. However, PANI n…

Electrochemical sensors and biosensorsAdvanced Sensor and Energy Harvesting MaterialsConducting polymers and applications

Effect of Changes in Relative Humidity and Temperature on Ultrathin Chitosan Films

Christopher Murray、John Dutcher2006-11-21Biomacromolecules

We have prepared uniform films of chitosan with thicknesses 20 nm < h < 200 nm by spincoating solutions of chitosan dissolved in dilute acetic acid onto silicon substrates while controlling the spin speed and the relative humidity inside the spincoater. After neutralizing the films, they readily absorbed water in the…

Nanocomposite Films for Food PackagingConducting polymers and applicationsPolydiacetylene-based materials and applications

Synthesis, Assembly, and Optical Properties of Shape- and Phase-Controlled ZnSe Nanostructures

Asit Baran Panda、Somobrata Acharya、Shlomo Efrima 等 4 位作者2006-11-21Langmuir

Shape-, size-, and phase-controlled ZnSe nanostructures were synthesized by thermolysis of zinc acetate and selenourea using liganding solvents of octadecylamine (ODA) and trioctylphosphineoxide (TOPO) at different molar ratios. Materials synthesized in pure ODA resulted in uniform ultranarrow nanorods and nanowires o…

Quantum Dots Synthesis And PropertiesChalcogenide Semiconductor Thin FilmsNanowire Synthesis and Applications

Synthesis of Biocompatible Poly[2-(methacryloyloxy)ethyl phosphorylcholine]-Coated Magnetite Nanoparticles

Jian Jun Yuan、Steven P. Armes、Yasuhiro Takabayashi 等 7 位作者2006-11-21Langmuir

A well-defined, double-hydrophilic diblock copolymer comprising poly[2-(methacryloyloxy)ethyl phosphorylcholine]-block-(glycerol monomethacrylate) (PMPC30-PGMA30, where the numbers represent the average degrees of polymerization for each block) was evaluated for the synthesis of colloidally stable ultrafine magnetite…

Bone Tissue Engineering MaterialsNanoparticle-Based Drug Deliverybiodegradable polymer synthesis and properties

Kinetics of carbon nanotubeoxidation

Roman Brukh、Somenath Mitra2006-11-21Journal of Materials Chemistry

Carbon nanotubes, graphite and amorphous carbon are structurally different, which is reflected in their reactivity and the resistance to oxidation. This paper reports the stability of single- and multi-walled nanotubes, and their true oxidation rates based on conversion to CO2 when heated in the presence of oxygen. No…

Carbon Nanotubes in CompositesGraphene research and applicationsFiber-reinforced polymer composites

22π Smaragdyrin Molecular Conjugates with Aromatic Phenylacetylenes and Ferrocenes: Syntheses, Electrochemical, and Photonic Properties

Rajneesh Misra、Rajeev Kumar、Tavarekere K. Chandrashekar 等 6 位作者2006-11-21Journal of the American Chemical Society

Syntheses, spectroscopic, electrochemical, and third-order nonlinear optical susceptibilities of a series of 22pi smaragdyrins and their corresponding Rh(I) derivatives bearing phenylacetylene substituents and ferrocene-containing substituents are reported. The synthetic strategy involved a [3 + 2] acid-catalyzed oxid…

Porphyrin and Phthalocyanine ChemistryNonlinear Optical Materials ResearchNonlinear Optical Materials Studies