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Ab initio study of structural, electronic, elastic, and phonon properties of ScN and ScP at ambient and high pressure

Premlata Pandit、Bipul Rakshit、Sankar P. Sanyal2010-09-09physica status solidi (b)

Abstract The structural, electronic, and elastic properties of ScN and ScP in NaCl (B 1 phase) and CsCl (B 2 phase) structures and the phonon dispersion at ambient and high pressure, close to phase transition, have been investigated by using first‐principles pseudopotential method in the framework of density functiona…

Metal and Thin Film MechanicsBoron and Carbon Nanomaterials ResearchMXene and MAX Phase Materials

Comparative Studies on the Mechanical, Degradation and Interfacial Properties between Jute and E-Glass Fiber-Reinforced PET Composites

Tanzina Huq、Avik Khan、Nazia Noor 等 7 位作者2010-09-09Polymer-Plastics Technology and Engineering

Jute fiber mat (hessian cloth) reinforced PET-based composites (50% fiber by weight) and E-glass fiber matreinforced PET based composites (50% fiber by weight) were fabricated by compression molding and the mechanical properties tensile strength (TS), tensile modulus (TM), elongation at break (%), bending strength (BS…

Mechanical Behavior of CompositesNatural Fiber Reinforced CompositesFiber-reinforced polymer composites

Microstructure and thermal conductivity of spark plasma sintering AlN ceramics

Xuan He、F. Ye、L. M. Liu 等 4 位作者2010-09-09Materials Science and Technology

Dense aluminium nitride ceramics were prepared by spark plasma sintering at a lower sintering temperature of 1700°C with Y 2 O 3 , Sm 2 O 3 and Dy 2 O 3 as sintering additives respectively. The effects of three kinds of sintering additives on the phase composition, microstructure and thermal conductivity of AlN cerami…

Advanced ceramic materials synthesisThermal properties of materialsMicrowave Dielectric Ceramics Synthesis

Interaction of NH3 with the reduced surface of graphite fluoride C2F

A. V. Okotrub、K. S. Babin、А. В. Гусельников 等 5 位作者2010-09-09physica status solidi (b)

Abstract A treatment of graphite fluoride C 2 F with hydrazine vapor resulted in development of conductive surface layer. Exposure of the reduced C 2 F sample to gaseous NH 3 (∼5% in ambient air) was shown to lead to rapid increase in layer resistance. Relative change of resistance averaged over three cycles is ∼14%.…

Graphene research and applicationsGas Sensing Nanomaterials and SensorsPlasma Diagnostics and Applications

Molecularly Intercalated Nanoflakes: A Supramolecular Composite for Strong Energy Absorption

Chichao Yu、Ziguang Chen、Hui Li 等 9 位作者2010-09-09Advanced Materials

Nanoflakes, one type of supramolecules that consist of alternating inorganic layers separated by organic moieties, are demonstrated as a good candidate for energy absorption as a thin film. When a bulky molecule is inserted between those layered structures, both modulus and specific energy absorption were increased 12…

Graphene research and applicationsForce Microscopy Techniques and ApplicationsBoron and Carbon Nanomaterials Research

Optical nonlinearity in lead sulfide microtowers

V. Tamilselvan、Kishore Sridharan、K. Narasimha Rao 等 4 位作者2010-09-09Journal of Physics D Applied Physics

Lead sulfide (PbS) microtowers on silicon substrates, having the physical properties of bulk PbS, have been synthesized. Optical nonlinearity studies using the open aperture z-scan technique employing 5 ns and 100 fs laser pulses reveal effective two-photon type absorption. For nanosecond excitation the nonlinear abso…

Quantum Dots Synthesis And PropertiesChalcogenide Semiconductor Thin FilmsNonlinear Optical Materials Studies

Encapsulation of electrical contacts for suspended single‐walled carbon nanotubes by atomic layer deposition

Matthias Muoth、Shih‐Wei Lee、Kiran Chikkadi 等 7 位作者2010-09-09physica status solidi (b)

Abstract We show encapsulation of electrical contacts to freestanding single‐walled carbon nanotubes (SWNTs) by selective nucleation of Al 2 O 3 from atomic layer deposition (ALD). Passivating electrical contacts is often required to prevent degradation of devices, and for chemical sensing it can separate sensing mech…

Carbon Nanotubes in CompositesGraphene research and applicationsSemiconductor materials and devices

Phonon thermal conductivity suppression of bulk silicon nanowire composites for efficient thermoelectric conversion

Ting‐Gang Chen、Peichen Yu、Rone-Hwa Chou 等 4 位作者2010-09-09Optics Express

Vertically-aligned silicon nanowires (SiNWs) that demonstrate reductions of phonon thermal conductivities are ideal components for thermoelectric devices. In this paper, we present large-area silicon nanowire arrays in various lengths using a silver-induced, electroless-etching method that is applicable to both n- and…

Advanced Thermoelectric Materials and DevicesThermal properties of materialsThermal Radiation and Cooling Technologies

Charge transfer and tunable minority band gap at the Fermi energy of a quaternaryCo2(MnxTi1−x)GeHeusler alloy

Peter Klaer、T. Bos、M. Kallmayer 等 10 位作者2010-09-09Physical Review B

We investigate the distribution of element-specific magnetic moments and changes in the spin-resolved unoccupied density of states in a series of half-metallic ${\text{Co}}_{2}({\text{Mn}}_{x}{\text{Ti}}_{1\ensuremath{-}x})\text{Ge}$ Heusler alloys using x-ray magnetic circular dichroism. The Co and Mn magnetic moment…

2D Materials and ApplicationsMXene and MAX Phase MaterialsHeusler alloys: electronic and magnetic properties

Magnetoelectric effects studied by resonant x-ray diffraction in ferrimagneticGaFeO3

U. Staub、Y. Bodenthin、Cínthia Piamonteze 等 7 位作者2010-09-09Physical Review B

Resonant x-ray Bragg diffraction experiments on space group forbidden reflections of type $(0k0)$ with $k$ odd taken in the vicinity of the $\text{Fe}\text{ }K$ edge are used to study magnetoelectric effects in ${\text{GaFeO}}_{3}$. The main intensity of the various spectral features is caused by the E1-E1 transition…

Magnetic and transport properties of perovskites and related materialsMultiferroics and related materialsAdvanced Condensed Matter Physics

Optical gaps of free and embedded Si nanoclusters: Density functional theory calculations

Timothy J. Pennycook、G. Hadjisavvas、Juan Carlos Idrobo 等 5 位作者2010-09-09Physical Review B

The optical gaps of free and embedded Si nanoclusters are studied within the time-dependent local-density approximation. The effects of deformation, the bonding of individual O atoms on the surface, and coverage by ${\text{SiO}}_{2}$ layers on the highest occupied molecular orbital-lowest unoccupied molecular orbital…

Semiconductor materials and devicesSilicon Nanostructures and PhotoluminescenceSemiconductor materials and interfaces

Tensile properties of kenaf/unsaturated polyester composites filled with a montmorillonite filler

H. D. Rozman、Luqman Musa、A. A. Azniwati 等 4 位作者2010-09-09Journal of Applied Polymer Science

Abstract Kenaf/unsaturated polyester composites filled with montmorillonite (MMT) filler were produced. Overall, the study showed that, for samples with kenaf filler only, the strength properties decreased as the kenaf filler loading was increased from 40 to 60%. The increase in the kenaf filler loading reduced the am…

Structural Behavior of Reinforced ConcretePolymer Nanocomposites and PropertiesNatural Fiber Reinforced Composites

Modelling wafer bow in silicon–polycrystalline CVD diamond substrates for GaN-based devices

M.J. Edwards、Chris Bowen、D.W.E. Allsopp 等 4 位作者2010-09-09Journal of Physics D Applied Physics

Composite silicon–polycrystalline chemical vapour deposition (CVD) diamond wafers are potential substrates for GaN-based devices for use in harsh environments due to their high thermal conductivity and chemical stability. When cooled from a typical diamond deposition temperature of approximately 800 to 25 °C wafer bow…

Metal and Thin Film MechanicsDiamond and Carbon-based Materials ResearchAdvanced Surface Polishing Techniques

Direct Observation of Transient Ostwald Crystallization Ordering from Racemic Serine Solutions

Victoria Hall、Garth J. Simpson2010-09-09Journal of the American Chemical Society

The Ostwald rule of stages describes the conjectured transitioning through metastable polymorphic crystal structures during crystallization. Direct observation of the Ostwald rule of stages using was performed using solutions of simple amino acids by second-order nonlinear optical imaging of chiral crystals (SONICC).…

Spectroscopy and Quantum Chemical StudiesCrystallization and Solubility StudiesMolecular spectroscopy and chirality

An Efficient Route to Nanostructured Tungsten Oxide Films with Improved Electrochromic Properties

Wei‐Ting Wu、Wen‐Pin Liao、Jen‐Sue Chen 等 4 位作者2010-09-09ChemPhysChem

An effective chemical route to nanostructured tungsten oxide films derived from a peroxopolytungstic acid (PTA)/thiourea precursor solution is demonstrated. The conventional procedure of preparing the precursor needs more than 24 h for well-mixing and refluxing the PTA-based solution, while the thiourea-assisted appro…

Gas Sensing Nanomaterials and SensorsTransition Metal Oxide NanomaterialsGa2O3 and related materials

Low-temperature synthesis of CdSe nanocrystal quantum dots

Jacqueline T. Siy、Eric M. Brauser、Michael H. Bartl2010-09-09Chemical Communications

A method for fabricating colloidal CdSe nanocrystals at low reaction temperatures was developed. The transition from CdSe clusters to continuously-growing nanocrystals was found to be crucial in the formation of high-quality quantum dots with narrow size distribution and efficient, tunable optical properties.

Quantum Dots Synthesis And PropertiesChalcogenide Semiconductor Thin FilmsNanocluster Synthesis and Applications

Room-Temperature Synthesis of Nickel Borides via Decomposition of NaBH4 Promoted by Nickel Bromide

Riccarda Caputo、Fabrizio Guzzetta、Alexander Angerhofer2010-09-09Inorganic Chemistry

We report the formation of nickel borides, at room temperature and pressure, from the decomposition of NaBH(4) promoted by the addition of nickel bromide at different concentrations in a dispersing organic medium, tetrahydrofuran and pentane. The nickel borides, formed as amorphous powders, were analyzed, and the stru…

High-pressure geophysics and materialsHydrogen Storage and MaterialsSuperconductivity in MgB2 and Alloys

Confining light in deep subwavelength electromagnetic cavities

Vincent Ginis、Philippe Tassin、C. M. Soukoulis 等 4 位作者2010-09-09Physical Review B

We demonstrate that it is possible to confine electromagnetic radiation in cavities that are significantly smaller than the wavelength of the radiation it encapsulates. To this aim, we use the techniques of transformation optics. First, we present a ``perfect cavity'' of arbitrarily small size in which such confined m…

Metamaterials and Metasurfaces ApplicationsPhotonic and Optical DevicesPhotonic Crystals and Applications

Coarse – grained molecular dynamics simulation of cross – linking of DGEBA epoxy resin and estimation of the adhesive strength

Arvind Prasad、T Grover、Sumit Basu2010-09-09International Journal of Engineering Science and Technology

In this work we attempt to predict the work of separation of crosslinked diglycidyl ether of bisphenol (A) (DGEBA) adhesive confined between two rigid adherends. To this end we start from merely the molecular structure of DGEBA and coarse grain the molecule into a chain comprised of three superatoms. These three super…

Advanced Physical and Chemical Molecular InteractionsIon-surface interactions and analysisChemical and Physical Properties of Materials

Comparison of bond scission sequence of methanol on tungsten monocarbide and Pt-modified tungsten monocarbide

Alan L. Stottlemyer、Ping Liu、Jingguang G. Chen2010-09-09The Journal of Chemical Physics

The ability to control the bond scission sequence of O-H, C-H, and C-O bonds is of critical importance in the effective utilization of oxygenate molecules, such as in reforming reactions and in alcohol fuel cells. In the current study, we use methanol as a probe molecule to demonstrate the possibility to control the d…

Electrocatalysts for Energy ConversionCatalytic Processes in Materials ScienceCatalysis and Oxidation Reactions