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Would the Pseudocoordination Centre Method Be Appropriate To Describe the Geometries of Lanthanide Complexes?

Danilo A. Rodrigues、Nivan B. da Costa、Ricardo O. Freire2010-11-30Journal of Chemical Information and Modeling

The correct prediction of the ground-state geometries of lanthanide complexes is an important step in the development of efficient light conversion molecular devices (LCMD). Considering this, we evaluate here the capability of semiempirical approaches and ab initio effective core potential (ECP) methodology in reprodu…

Metal complexes synthesis and propertiesMagnetism in coordination complexesLanthanide and Transition Metal Complexes

Nanoscale Devices for Large-Scale Applications

Nima Rouhi、Dheeraj Jain、Peter J. Burke2010-11-30IEEE Microwave Magazine

In this article, the authors review the progress toward carbon nanotube based electronics and consider the implications for application of nanotubes in analogue RF devices and RF system applications as well as recent prospects in printed electronics, especially printed RFID tags. The author also points out that nanowi…

Carbon Nanotubes in CompositesGraphene research and applicationsNanowire Synthesis and Applications

Confinement effects for ionic carriers in SrTiO 3 ultrathin films: first-principles calculations of oxygen vacancies

E. A. Kotomin、Vitaly Alexandrov、Denis Gryaznov 等 5 位作者2010-11-30Physical Chemistry Chemical Physics

One-dimensional confinement effects are modelled within the hybrid HF-DFT LCAO approach considering neutral and single-charged oxygen vacancies in SrTiO(3) ultrathin films. The calculations reveal that confinement effects are surprisingly short-range in this partly covalent perovskite; already for film thickness of 2-…

Ferroelectric and Piezoelectric MaterialsSemiconductor materials and devicesElectronic and Structural Properties of Oxides

Synthesis and Characterization of Conductive Polyaniline-Modified Polymers via Nitroxide Mediated Radical Polymerization

Mehdi Jaymand2010-11-30Polymer(Korea)

The paper describes the preparation and characterization of conductive polyaniline-modified polymers by growing of aniline onto functionalized poly(styrene-co-p-methylstyrene) [P(St-co-MSt)]. For this purpose. P(St-co-MSt) was synthesized via nitroxide mediated radical polymerization (NMRP) and then N-boromosuccinimid…

Electrochemical sensors and biosensorsConducting polymers and applicationsAnalytical Chemistry and Sensors

Structures of Pd(CN)2 and Pt(CN)2: Intrinsically Nanocrystalline Materials?

Simon J. Hibble、Ann M. Chippindale、Edward J. Bilbé 等 6 位作者2010-11-30Inorganic Chemistry

Analysis and modeling of X-ray and neutron Bragg and total diffraction data show that the compounds referred to in the literature as "Pd(CN)(2)" and "Pt(CN)(2)" are nanocrystalline materials containing small sheets of vertex-sharing square-planar M(CN)(4) units, layered in a disordered manner with an intersheet separa…

Boron and Carbon Nanomaterials ResearchThermal and Kinetic AnalysisThermal Expansion and Ionic Conductivity

Resonant absorption in transition metamaterials: parametric study

Ethan A. Gibson、Matthew Pennybacker、A. I. Maĭmistov 等 5 位作者2010-11-30Journal of Optics

We perform a detailed study of the phenomenon of resonant absorption that occurs at an oblique incidence in the vicinity of the zero refractive index transition in graded index metamaterials with the refractive index changing from positive to negative values. We compare the results of numerical simulations with analyt…

Metamaterials and Metasurfaces ApplicationsPlasmonic and Surface Plasmon ResearchAdvanced Antenna and Metasurface Technologies

A crystal chemical approach to superconductivity. I. A bond-valence sum analysis of inorganic compounds

F. Liebau、Hans‐Joachim Klein、Xiqu Wang2010-11-30Zeitschrift für Kristallographie

A crystal-chemical approach to superconductivity is described that is intended to complement the corresponding physical approach. The former approach takes into account the distinction between the stoichiometric valence ( stoich V ) and the structural valence ( struct V ) which is represented by the bond-valence sums…

Rare-earth and actinide compoundsIron-based superconductors researchInorganic Chemistry and Materials

Nonstoichiometry and bond character in unconventional superconductors

F. Liebau2010-11-30Zeitschrift für Kristallographie

The presence of mixed valency in unconventional superconductors is a necessary consequence of the fact that there is chemical equilibrium between the atoms of a transition element having different oxidation states. Consequently, phases described by stoichiometric formulas such as FeSe, Ba(FeAs) 2 , La 2 CuO 4 etc. dev…

Physics of Superconductivity and MagnetismMagnetic and transport properties of perovskites and related materialsIron-based superconductors research

Hydrothermal Synthesis and Crystal Structure of a New Bisupporting Metal-Oxygen Cluster with Bicapped Pseudo-Keggin Structure: [CuII{Cl0.5Cl(phen)}]2{[PMoV 6MoVI 6O40(VIVO)2][CuII(phen)2]2}·2H2O (phen = 1,10-Phenathroline)

Dong‐Bin Dang、Yanhua Fan、Yan Bai 等 4 位作者2010-11-30Synthesis and Reactivity in Inorganic Metal-Organic and Nano-Metal Chemistry

A new bisupporting metal-oxygen cluster with bicapped pseudo-Keggin compound [CuII{Cl0.5Cl(phen)}]2 {[PMoV 6MoVI 6O40(VIVO)2][CuII(phen)2]2}·2H2O (phen = 1,10-phenathroline) has been synthesized by hydrothermal method and characterized by elemental analysis, IR spectroscopy, TGA, XRPD, and single-crystal X-ray diffrac…

Metal-Organic Frameworks: Synthesis and ApplicationsPolyoxometalates: Synthesis and ApplicationsVanadium and Halogenation Chemistry

CORROSION BEHAVIORS OF LOW ALLOY STEEL AND CARBON STEEL DEPOSITED WITH NaCl AND NaHSO<SUB>3</SUB> UNDER DRY/HUMID ALTERNATIVE CONDITION

Quancheng Yu、Zhenyao WANG、Chuan Wang2010-11-30Acta Metallurgica Sinica

The corrosion behaviors of low alloy steel P265GH and carbon steel Q235 deposited with NaCl and NaHSO_3 under dry/humid alternative condition were investigated by FTIR,XRD,SEM and galvanostatic method.The results reveal that under present experimental condition,corrosion rates of low alloy steel and carbon steel decre…

Corrosion Behavior and InhibitionHydrogen embrittlement and corrosion behaviors in metalsNon-Destructive Testing Techniques

A New Index for Evaluating the Mechanical Comfort of Linen Fabric

Amine Hadj Taieb、Slah Msahli、Faouzi Sakli2010-11-30Journal of Natural Fibers

The linen is a leading comfortable fabric, but how can we evaluate this comfort? The comfort is a multicriteria phenomenon that requires the simultaneous satisfaction of several criteria. In this study, we try to represent objectively the mechanical comfort components to simulate the consumer comfort perception. This…

Textile materials and evaluationsErgonomics and Musculoskeletal DisordersColor perception and design

Organic–Inorganic Hybrid Saponites Obtained by Intercalation of Titano‐Silsesquioxane

Fabio Carniato、Chiara Bisio、Giorgio Gatti 等 6 位作者2010-11-30Chemistry - An Asian Journal

The synthesis and characterization of two bifunctional composite materials based on synthetic saponite clays is here presented. These materials were prepared by intercalation of a Ti-containing aminopropylisobutyl polyhedral oligomeric silsesquioxane (Ti-NH(2) POSS) in synthetic saponite samples containing interlayer…

Advanced ceramic materials synthesisSilicone and Siloxane ChemistryChemical Synthesis and Characterization

Poly(ethylene‐vinyl co‐vinyl acetate)/clay nanocomposites: Mechanical, morphology, and thermal behavior

Susan Joseph、Walter W. Focke2010-11-30Polymer Composites

Abstract Nanocomposites of ethylene‐vinyl acetate copolymer (EVAL) with Dellite organoclay were prepared in a laboratory extruder. The extent of intercalation of the nanocomposites was studied by field emission scanning electron microscopy and X‐ray diffraction. It was established that the organoclay is well dispersed…

Polymer crystallization and propertiesPolymer Nanocomposites and PropertiesPolymer Nanocomposite Synthesis and Irradiation

Electrical Field Enhancement in Carbon Nanotube-Based Electron Field Cathodes

G. S. Bocharov、M. D. Belsky、А. В. Елецкий 等 4 位作者2010-11-30Fullerenes Nanotubes and Carbon Nanostructures

The problem of evaluating the field amplification factor in electron field emitters on the basis of carbon nanotubes (CNT) has been considered. The electrostatic problem of determination of the field amplification factor for CNTs having various structures of the tip, depending on the tilting angle in regard to the cat…

Carbon Nanotubes in CompositesGraphene research and applicationsNanotechnology research and applications

Broadband dielectric investigations of indium rich CuInP2S6layered crystals

A. Dziaugys、J. Banys、Yulian M. Vysochanskii2010-11-30Zeitschrift für Kristallographie

Results on dielectric properties of layered indium rich CuIn 1+ δ P 2 S 6 crystals are presented. At low frequencies and high temperatures, the dielectric spectra are strongly influenced by the high ionic conductivity with the activation energy corresponding to 6815 K (0.587 eV). The high-frequency part of the dielect…

Ferroelectric and Piezoelectric MaterialsPhotorefractive and Nonlinear OpticsOptical and Acousto-Optic Technologies

In situ neutron diffraction study of electric field induced structural transitions in lanthanum doped lead zirconate titanate

Manuel Hinterstein、Markus Hoelzel、Hans Kungl 等 6 位作者2010-11-30Zeitschrift für Kristallographie

The structural reaction of La-doped PbZr 1– x Ti x O 3 (PLZT) with x = 0.44, 0.46 and 0.475 to an electric field was investigated by in situ neutron diffraction. The induced structural changes and the anisotropic displacement parameters were analysed. While the composition with a high Ti content shows a trend to tetra…

Ferroelectric and Piezoelectric MaterialsSolid-state spectroscopy and crystallographyMicrowave Dielectric Ceramics Synthesis

Unsteady-state inhibition of crystal growth caused by solution impurities

Pedro M. Martins、Fernando Rocha、Ana M. Damas 等 4 位作者2010-11-30CrystEngComm

The competitive adsorption model under unsteady state conditions (CAMUS) is presented and validated against experimental results of crystal growth inhibition in the presence of impurities. Particular emphasis is given to peculiar growth rate trends documented in the literature that are unexpected by the existing theor…

Calcium Carbonate Crystallization and InhibitionCrystallization and Solubility StudiesFreezing and Crystallization Processes

Morphologies and Magnetic Properties of Cobalt-Iron Prussian Blue Analogues Nanoparticles Synthesized in Microemulsion

Hui Liu、Xian‐Long Du、Chuanhui Liang 等 8 位作者2010-11-30Synthesis and Reactivity in Inorganic Metal-Organic and Nano-Metal Chemistry

The structure-dependent magnetic properties of cobalt-iron Prussian blue analogues (PBAs) with different morphologies synthesized in microemulsion were systematically explored by the characterization of XRD, IR, SQUID techniques, etc. And it was observed that both the w (water-to-surfactant molar ratio) and reactant c…

Magnetism in coordination complexesLanthanide and Transition Metal ComplexesNanocluster Synthesis and Applications

Microstructure and Permeability Property of Si Bonded Porous SiC with Variations in the Carbon Content

In‐Hyuck Song、Mijung Park、Hai-Doo Kim 等 5 位作者2010-11-30Journal of the Korean Ceramic Society

The achievement of high gas permeability is a key factor in the development of porous SiC ceramics for applications of hot gas filter, vacuum chuck, and air spindle. However, few reports on the gas permeability of porous SiC ceramics can be found in the literature. In this paper, porous SiC ceramics were fabricated at…

Advanced ceramic materials synthesisSemiconductor materials and devicesDiamond and Carbon-based Materials Research

Liposil-supported lipid bilayers as a hybrid platform for drug delivery

Shukun Shen、Eric L. Kendall、Ann E. Oliver 等 6 位作者2010-11-30Soft Matter

We report a hybrid drug delivery system inspired by the functional compartmentalization of cell, isolating properties of cargo encapsulation, targeting, stability, biocompatibility, and permeability into discrete multilamellar organic-inorganic–organic design consisting of two differently functionalized lipid bilayers…

Nanoparticle-Based Drug DeliveryAdvanced biosensing and bioanalysis techniquesSupramolecular Self-Assembly in Materials