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Oxygen vacancies or/and antisite imperfections in Sr2FeMoO6 double perovskites: an ab initio investigation

D. Stoeffler、S. Colis2005-09-30Journal of Physics Condensed Matter

We report on electronic band structure calculations, using the ab initio full potential linearized augmented plane wave (FLAPW) method, for Sr 2 FeMoO 6 (SFMO) double perovskites presenting antisite defects or/and oxygen vacancies. We exhibit that the half-metallic character is preserved for SFMO containing only nearl…

Magnetic and transport properties of perovskites and related materialsAdvanced Condensed Matter PhysicsElectronic and Structural Properties of Oxides

Synthesis and Properties of Poly(phenylene ethynylene)s with Pendant Hexafluoro-2-propanol Groups

John P. Amara、Timothy M. Swager2005-09-30Macromolecules

Several poly(phenylene ethynylene)s with pendant hexafluoro-2-propanol (HFIP) groups have been synthesized and characterized in terms of their solution and thin-film optical properties. The incorporation of strongly hydrogen-bond-donating HFIP groups into conjugated polymers is shown to greatly enhance their fluoresce…

Molecular Sensors and Ion DetectionLuminescence and Fluorescent MaterialsAnalytical Chemistry and Sensors

Cyanide-Bridged W(V)−Mn(II) Bimetallic Double-Zigzag Chains with a Metamagnetic Nature

Jung Hee Yoon、Hyoung Chan Kim、Chang Seop Hong2005-09-30Inorganic Chemistry

A cyanide-bridged W-Mn bimetallic compound [W(CN)(6)(bpy)](2)[Mn(H(2)O)(2)].4H(2)O (1) (bpy = 2,2'-bipyridine) with a one-dimensional, crossed double-zigzag chain structure was prepared by self-assembling [W(CN)(6)(bpy)](-) and Mn(2+) ions in a 2:1 reaction ratio. The magnetic properties of 1 exhibit a field-induced m…

Magnetism in coordination complexesLanthanide and Transition Metal ComplexesMetalloenzymes and iron-sulfur proteins

Bridging the gap between the mode coupling and the random first order transition theories of structural relaxation in liquids

Sarika Maitra Bhattacharyya、Biman Bagchi、Peter G. Wolynes2005-09-30Physical Review E

A unified treatment of structural relaxation in a deeply supercooled glassy liquid is developed which extends the existing mode coupling theory (MCT) by incorporating, in a self-consistent way, the effects of activated events by using the concepts from the random first order transition (RFOT) theory. We show how the d…

Material Dynamics and PropertiesThermodynamic properties of mixturesSpectroscopy and Quantum Chemical Studies

Scattering Studies of Nanoporous Organosilicate Thin Films Imprinted with Reactive Star Porogens

Byung Hui Lee、Weontae Oh、Jinhwan Yoon 等 8 位作者2005-09-30Macromolecules

ADVERTISEMENT RETURN TO ISSUEPREVCommunication to the...Communication to the EditorNEXTScattering Studies of Nanoporous Organosilicate Thin Films Imprinted with Reactive Star PorogensB. Lee, W. Oh, J. Yoon, Y. Hwang, J. Kim, B. G. Landes, J. P. Quintana, and M. ReeView Author Information National Research Lab for Poly…

Mesoporous Materials and CatalysisBlock Copolymer Self-AssemblyCopper Interconnects and Reliability

Enhanced Photodegradation of 2,4,6-Trichlorophenol over Palladium Phthalocyaninesulfonate Modified Organobentonite

Zhigang Xiong、Yiming Xu、Lizhong Zhu 等 4 位作者2005-09-30Langmuir

This article explores a supported photocatalyst of palladium(II) phthalocyaninesulfonate (PdPcS) onto organoclay for removal of 2,4,6-trichlorophenol (TCP) from water under visible light (lambda > or = 450 nm) irradiation. The composite clay was not only a good sorbent for uptake of TCP from water, but it also exhibit…

Advanced Photocatalysis TechniquesAdvanced oxidation water treatmentPorphyrin and Phthalocyanine Chemistry

Surface laser emission from solid polymer dye in a guided mode resonant grating filter structure

Takashi Kobayashi、Yoshiaki Kanamori、Kazuhiro Hane2005-09-30Applied Physics Letters

This letter describes the design, fabrication, and experimental results of a micro solid polymer dye laser designed on the basis of a guided mode resonant grating (GMRG). The resonant condition of GMRG includes the second-order resonance of the distributed feedback cavity. A surface laser emission was obtained in a pa…

Photonic and Optical DevicesOptical Coatings and GratingsSurface Roughness and Optical Measurements

Spectroscopic properties of Er3+ions in transparent oxyfluoride glass ceramics containing CaF2nano-crystals

Daqin Chen、Yuansheng Wang、Yunlong Yu 等 5 位作者2005-09-30Journal of Physics Condensed Matter

In this paper, the spectroscopic properties of Er3+-doped oxyfluoride glass ceramics containing CaF2 nano-crystals are systematically investigated. X-ray diffraction (XRD) and transmission electron microscope (TEM) experiments confirmed the formation of CaF2 nano-crystals in the glassy matrix. Based on the Judd–Ofelt…

Luminescence Properties of Advanced MaterialsGlass properties and applicationsSolid State Laser Technologies

Phase diagram of amorphous solid water: Low-density, high-density, and very-high-density amorphous ices

Nicolás Giovambattista、H. Eugene Stanley、Francesco Sciortino2005-09-30Physical Review E

We calculate the phase diagram of amorphous solid water by performing molecular dynamics simulations using the extended simple point charge (SPC/E) model. Our simulations follow different paths in the phase diagram: isothermal compression/decompression, isochoric cooling/heating, and isobaric cooling/heating. We are a…

Material Dynamics and PropertiesGlass properties and applicationsTheoretical and Computational Physics

Properties of a Novel Intracellular Poly(3-Hydroxybutyrate) Depolymerase with High Specific Activity (PhaZd) in Wautersia eutropha H16

Tomoko Abe、Teruyuki Kobayashi、Terumi Saito2005-09-30Journal of Bacteriology

A novel intracellular poly(3-hydroxybutyrate) (PHB) depolymerase (PhaZd) of Wautersia eutropha (formerly Ralstonia eutropha) H16 which shows similarity with the catalytic domain of the extracellular PHB depolymerase in Ralstonia pickettii T1 was identified. The positions of the catalytic triad (Ser190-Asp266-His330) a…

biodegradable polymer synthesis and propertiesPolyamine Metabolism and ApplicationsAmino Acid Enzymes and Metabolism

Properties of ZnO thin films grown on Si substrates by MOCVD and ZnO/Si heterojunctions

Yuantao Zhang、Guotong Du、Baolin Zhang 等 6 位作者2005-09-30Semiconductor Science and Technology

Undoped n-ZnO thin films were successfully grown on p-Si (1 0 0) substrates by low-pressure metalorganic chemical vapour deposition (MOCVD). The c -axis oriented ZnO films were grown on Si at different temperatures using diethylzinc (DEZn) and oxygen (O 2 ). The structural and optical properties of ZnO films were inve…

ZnO doping and propertiesChalcogenide Semiconductor Thin FilmsCopper-based nanomaterials and applications

Advanced semiconductor nanostructures

Lionel Vayssières2005-09-30Comptes Rendus Chimie

A novel approach to large bandgap semiconductor materials design is demonstrated. Based on a thermodynamical growth control concept, a low temperature aqueous thin film growth technique is presented to produce, at large scale and low cost, novel metal oxide-based nano- to micro-structures. Three-dimensional arrays con…

ZnO doping and propertiesCopper-based nanomaterials and applicationsElectronic and Structural Properties of Oxides

Bis‐dendritic polyethylene prepared by ring‐opening metathesis polymerization in the presence of bis‐dendritic chain transfer agents

Kevin Sill、Todd Emrick2005-09-30Journal of Polymer Science Part A Polymer Chemistry

Abstract The synthesis of ABA triblock copolymers is described, in which the A blocks are poly(benzyl ether) dendrons and the B block is polycyclooctene or polyethylene. Bis‐dendritic cis ‐olefins were synthesized and used as chain transfer agents in ring‐opening metathesis polymerization of cyclooctene in a process t…

Synthetic Organic Chemistry MethodsDendrimers and Hyperbranched Polymers

Andic properties in soils developed from nonvolcanic materials in Central Bhutan

Rupert Bäumler、Thomas Caspari、Kai Uwe Totsche 等 6 位作者2005-09-30Journal of Plant Nutrition and Soil Science

A number of soils are described in the literature as having andic and spodic soil properties, but have developed in nonvolcanic and nonallophanic materials and lack typical Podzol eluvial and illuvial horizons. They cover a wide range of parent materials and different types of climate. They have always been regarded a…

Soil and Unsaturated FlowClay minerals and soil interactionsSoil Management and Crop Yield

Ex situ ellipsometric investigation of nanocolumns inclination angle of obliquely evaporated silicon thin films

Gisia Beydaghyan、Cristina Buzea、Yan Cui 等 5 位作者2005-09-30Applied Physics Letters

We propose an application of spectroscopic ellipsometry pertinent to the characterization of nanostructure inclination of oblique thin films. This technique is employed ex situ in the measurement of silicon thin films fabricated at oblique incidence and modeled as aggregate microstructures formed from amorphous silico…

Thin-Film Transistor TechnologiesSilicon Nanostructures and PhotoluminescenceOptical Coatings and Gratings

Growth of ZnO hexagonal nanoprisms

D F Liu、Y. Xiang、Z X Zhang 等 14 位作者2005-09-30Nanotechnology

We show the success of large-scale growth of ZnO hexagonal nanoprisms on silicon substrates by a two-staged mechanism. In the first stage, the catalyst nanoparticles assisted the nucleation via the vapour–liquid–solid (VLS) mechanism to form polyhedral nanoparticles. In the second stage, the nanoprism was grown up by…

ZnO doping and propertiesQuantum Dots Synthesis And PropertiesCopper-based nanomaterials and applications

Barrier and mechanical properties of methylcellulose–whey protein films

Z. Özge Erdohan、K. Nazan Turhan2005-09-30Packaging Technology and Science

Abstract Water vapour permeability (WVP) and mechanical properties were assessed in edible films prepared from methylcellulose (MC) and MC–whey protein isolate (WPI) or MC–whey protein concentrate (WPC). Glycerol (Gly) was used as the plasticizer. Two MC–WP films were formulated. For Group I films, the mass ratio of W…

Nanocomposite Films for Food PackagingElectrospun Nanofibers in Biomedical ApplicationsMicroplastics and Plastic Pollution

Sedimentation and Phase Transitions of Colloidal Gibbsite Platelets

Judith E. G. J. Wijnhoven、Danielle D. van’t Zand、D. van der Beek 等 4 位作者2005-09-30Langmuir

We study the competition between sedimentation, gelation, and liquid crystal formation in suspensions of colloidal gibbsite platelets of five different sizes at three ionic strengths. For large particles (with diameters of 350, 420, and 570 nm) sedimentation is initially the most important factor determining the macro…

Material Dynamics and PropertiesSurfactants and Colloidal SystemsPickering emulsions and particle stabilization

Mesoscale modeling of electrical percolation in fiber-filled systems

Sameer S. Rahatekar、Marc Hamm、Milo S. P. Shaffer 等 4 位作者2005-09-30The Journal of Chemical Physics

The research described in this paper primarily involves mesoscale simulations: dissipative particle dynamics (DPD) of packed assemblies of oriented fibers suspended in a viscous medium. Computer simulations have been performed in order to explore how the aspect ratio and degree of fiber alignment affect the critical v…

Material Dynamics and PropertiesTheoretical and Computational PhysicsBlock Copolymer Self-Assembly