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Influence of coherent twin boundaries on three-point bending of gold nanowires

Junjie Zhang、Yongda Yan、X Liu 等 5 位作者2014-04-25Journal of Physics D Applied Physics

In the present work we elucidate the deformation mechanisms of twinned Au nanowires (NWs) under three-point bending by means of molecular dynamics simulations. We further investigate the effects of twin boundary orientation, NW diameter and twin boundary spacing on the mechanical properties and deformation behaviors o…

Microstructure and mechanical propertiesMetal and Thin Film MechanicsAluminum Alloys Composites Properties

The effect of interfaces on the mechanical behaviour of multilayered metallic laminates

Cameron Sobie、M.G. McPhie、Laurent Capolungo 等 4 位作者2014-04-25Modelling and Simulation in Materials Science and Engineering

The mechanical response of multilayered metallic laminates is dominated by size effects through the confinement of dislocation motion within the layers. We deconvolute the contributions to the plastic behaviour resulting from dislocation–dislocation interactions and dislocation–interface interactions, using discrete d…

Microstructure and mechanical propertiesMetal and Thin Film Mechanicsnanoparticles nucleation surface interactions

Copper export contributes to low copper levels and copper tolerance in Emiliania huxleyi

Michael J. Walsh、Beth A. Ahner2014-04-25Limnology and Oceanography

Previous studies have documented that the coccolithophore Emiliania huxleyi maintains lower cellular copper concentrations and is more tolerant to high copper than are many other species of marine algae. We confirm that in comparison to the diatom Thalassiosira pseudonana , E. huxleyi maintains substantially lower Cu…

Marine and coastal ecosystemsGeochemistry and Elemental AnalysisDiatoms and Algae Research

Relaxivity enhancement of aquated Tris(β‐diketonate)gadolinium(III) chelates by confinement within ultrashort single‐walled carbon nanotubes

Justin J. Law、Adem Guven、Lon J. Wilson2014-04-25Contrast Media & Molecular Imaging

Ultrashort single-walled carbon nanotubes loaded with gadolinium ions (gadonanotubes) have been previously shown to exhibit extremely high T1 -weighted relaxivities (>100 mm(-1) s(-1) ). To further examine the effect of nanoconfinement on the relaxivity of gadolinium-based contrast agents for magnetic resonance imagin…

Advanced MRI Techniques and ApplicationsLanthanide and Transition Metal ComplexesAdvanced NMR Techniques and Applications

Excitation Energy Transfer in Donor-Bridge-Acceptor Systems: A Combined Quantum-Mechanical/Classical Analysis of the Role of the Bridge and the Solvent

Stefano Caprasecca、Benedetta Mennucci2014-04-25The Journal of Physical Chemistry A

The technical application of excitation energy transfer requires a fine control of the geometry of the system. This can be achieved by introducing a chemical bridge between the donor and acceptor moieties that can be tuned in its chemical properties and its length. In such donor-bridge-acceptor systems, however, the r…

Porphyrin and Phthalocyanine ChemistryPhotochemistry and Electron Transfer StudiesSpectroscopy and Quantum Chemical Studies

Irradiation-enhanced twin boundary migration in BCC Fe

Dingkun Song、Xiaoguai Li、Jianming Xue 等 5 位作者2014-04-25Philosophical Magazine Letters

The effects of irradiation on twin boundary migration in BCC Fe are studied by atomistic simulations. It is found that under the applied shear strain–stress, thermal spikes may create twinning dislocation loops (TDLs) at twin boundaries, so triggering twinning. Irradiation-generated clusters of point defect at twin bo…

Microstructure and mechanical propertiesMicrostructure and Mechanical Properties of SteelsFusion materials and technologies

Lamella alignment ratio: a SAXS analysis technique for macromolecules

Eric Dalton、Maurice N. Collins2014-04-25Journal of Applied Crystallography

Polyethylenes with various morphologies were analysed, as a function of strain and radiation doses, using a novel lamella alignment ratio (LAR) technique on data obtained from small-angle X-ray scattering (SAXS) measurements at the Diamond Light Source synchrotron. The authors have used this technique previously to de…

Polymer crystallization and propertiesPolymer Nanocomposites and PropertiesOrthopaedic implants and arthroplasty

A Development of High Power Activated Carbon Using the KOH Activation of Soft Carbon Series Cokes

Jung‐Ae Kim、In-Soo Park、Ji-Hye Seo 等 4 位作者2014-04-25Transactions on Electrical and Electronic Materials

The process parameter in optimized KOH alkali activation of soft carbon series coke material in high purity was set with DOE experiments design. The activated carbon was produced by performing the activation process based on the set process parameters. The specific surface area was measured and pore size was analyzed…

Supercapacitor Materials and FabricationConducting polymers and applicationsMesoporous Materials and Catalysis

Improved flame retardancy and thermal stability of polymer/clay nanocomposites, with the incorporation of multiwalled carbon nanotube as secondary filler

Priyanka Pandey、Smita Mohanty、Sanjay K. Nayak2014-04-25High Performance Polymers

In the present study, the combined effect of multiwalled carbon nanotube (MWNT) and organoclay in improving the flame retardancy and thermal stability was evaluated. A novel ternary nanocomposite (polymer/organoclay/MWNT) material based on polypropylene, organoclay and MWNTs has been developed. Higher degree of delami…

Polymer Nanocomposites and PropertiesFlame retardant materials and propertiesSynthesis and properties of polymers

Controlling the dynamics of a bidimensional gel above and below its percolation transition

Davide Orsi、Beatrice Ruta、Yuriy Chushkin 等 8 位作者2014-04-25Physical Review E

The morphology and the microscopic internal dynamics of a bidimensional gel formed by spontaneous aggregation of gold nanoparticles confined at the water surface are investigated by a suite of techniques, including grazing-incidence x-ray photon correlation spectroscopy (GI-XPCS). The range of concentrations studied s…

Material Dynamics and PropertiesTheoretical and Computational PhysicsSpectroscopy and Quantum Chemical Studies

IR laser-induced protein crystal transformation

R. Kiefersauer、Brigitte Grandl、Stephan Krapp 等 4 位作者2014-04-25Acta Crystallographica Section D Biological Crystallography

A method and the design of instrumentation, and its preliminary practical realisation, including test experiments, with the object of inducing phase changes of biomolecular crystals by controlled dehydration through heating with infrared (IR) light are described. The aim is to generate and select crystalline phases th…

Protein Structure and DynamicsPhotosynthetic Processes and MechanismsEnzyme Structure and Function

NIR Dual Luminescence from an Extended Porphyrin. Spectroscopy, Photophysics and Theory

Christophe Gourlaouen、Chantal Daniel、Fabien Durola 等 8 位作者2014-04-25The Journal of Physical Chemistry A

Spectroscopic and photophysical properties of an extended Zn porphyrin with fused bis(tetraazaanthracene) arms including a 2,9-diphenyl-1,10-phenanthroline incorporated in a polyether macrocycle are investigated in solvents of different polarity pointing to the presence of two emitting singlet excited states. The abso…

Porphyrin and Phthalocyanine ChemistryPhotochemistry and Electron Transfer StudiesLuminescence and Fluorescent Materials

General Protocol for the Synthesis of Functionalized Magnetic Nanoparticles for Magnetic Resonance Imaging from Protected Metal–Organic Precursors

He Hu、Chongkun Zhang、Lu An 等 8 位作者2014-04-25Chemistry - A European Journal

The development of magnetic nanoparticles (MNPs) with functional groups has been intensively pursued in recent years. Herein, a simple, versatile, and cost-effective strategy to synthesize water-soluble and amino-functionalized MNPs, based on the thermal decomposition of phthalimide-protected metal-organic precursors…

Nanoparticle-Based Drug DeliveryNanocluster Synthesis and ApplicationsCharacterization and Applications of Magnetic Nanoparticles

Collective behaviour of dislocations in a finite medium

M Marleen Kooiman、Markus Hütter、M.G.D. Geers2014-04-25Journal of Statistical Mechanics Theory and Experiment

We derive the grand-canonical partition function of straight and parallel dislocation lines without making a priori assumptions on the temperature regime. Such a systematic derivation for dislocations has, to the best of our knowledge, not been carried out before, and several conflicting assumptions on the free energy…

Material Dynamics and PropertiesTheoretical and Computational PhysicsNanopore and Nanochannel Transport Studies

Compressive Strength and Capillary Pressure: Competing Properties of Particulate Suspensions that Determine the Onset of Desaturation

Anthony D. Stickland、Hui-En Teo、George V. Franks 等 4 位作者2014-04-25Drying Technology

The drying of particulate suspensions is important to many industries such as paints, ceramics, minerals processing, and pharmaceuticals. Cakes or films first consolidate due to capillary pressure and, at a critical concentration, stop consolidating and begin to desaturate. Desaturation occurs once the compressive str…

Surface Modification and SuperhydrophobicityFluid Dynamics and Heat TransferAerosol Filtration and Electrostatic Precipitation

Mapping the Fluorescence Performance of a Photochromic–Fluorescent System Coupled with Gold Nanoparticles at the Single-Molecule–Single-Particle Level

Sabrina Simoncelli、M. Julia Roberti、Beatriz Aráoz 等 5 位作者2014-04-25Journal of the American Chemical Society

Single-molecule (SM) fluorescence microscopy was used to investigate the photochromic fluorescent system spiropyran-merocyanine (SP ↔ MC) interacting with gold nanoparticles (AuNPs). We observe a significant increase in the brightness of the emissive MC form, in the duration of its ON time, and in the total number of…

Gold and Silver Nanoparticles Synthesis and ApplicationsAdvanced biosensing and bioanalysis techniquesPhotochromic and Fluorescence Chemistry

Tailoring of organic dyes with oxidoreductive compounds to obtain photocyclic radical generator systems exhibiting photocatalytic behavior

Christian Ley、Julien Christmann、Ahmad Ibrahim 等 5 位作者2014-04-25Beilstein Journal of Organic Chemistry

The combination of a dye which absorbs the photon, an electron acceptor and an electron donor leading to energy conversion through electron transfer, was the basis of the so called three-component systems. In this paper, an experimental work combining Rose bengal dye with a triazine derivative as electron acceptor and…

Advanced Photocatalysis TechniquesRadical Photochemical ReactionsPhotochromic and Fluorescence Chemistry

Environmentally Benign Bifunctional Solid Acid and Base Catalysts

Ahmed Elmekawy、N. Raveendran Shiju、Gadi Rothenberg 等 4 位作者2014-04-25Industrial & Engineering Chemistry Research

Solid bifunctional acid–base catalysts were prepared in two ways on an amorphous silica support: (1) by grafting mercaptopropyl units (followed by oxidation to propylsulfonic acid) and aminopropyl groups to the silica surface (NH 2 –SiO 2 –SO 3 H), and (2) by grafting only aminopropyl groups and then partially neutral…

Ionic liquids properties and applicationsMesoporous Materials and CatalysisAsymmetric Hydrogenation and Catalysis

Seeded-growth, nanocrystal-fusion, ion-exchange and inorganic-ligand mediated formation of semiconductor-based colloidal heterostructured nanocrystals

Angshuman Nag、Janardan Kundu、Abhijit Hazarika2014-04-25CrystEngComm

This article highlights different synthetic strategies for the preparation of colloidal heterostructured nanocrystals, where at least one component of the constituent nanostructure is a semiconductor. Growth of shell material on a core nanocrystal acting as a seed for heterogeneous nucleation of the shell has been dis…

Advanced Photocatalysis TechniquesQuantum Dots Synthesis And PropertiesChalcogenide Semiconductor Thin Films

Phase Identification and Structure Solution by Three-Dimensional Electron Diffraction Tomography: Gd–Phosphate Nanorods

Arnaud Mayence、Julien R. G. Navarro、Yanhang Ma 等 6 位作者2014-04-25Inorganic Chemistry

Hydrothermal synthesis of GdPO4 in the presence of poly(methacrylic acid) yields nanorods with a diameter of 15 nm and an aspect ratio of 20. Powder X-ray diffraction patterns showed that the GdPO4 nanorods display peaks characteristics for both monoclinic and hexagonal structures. Three-dimensional electron diffracti…

Luminescence Properties of Advanced MaterialsGlass properties and applicationsNuclear materials and radiation effects