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Stability of Edges and Extended Defects on Boron Nitride and Graphene Monolayers: The Role of Chemical Environment

Lídia Gomes、Simone S. Alexandre、Hélio Chacham 等 4 位作者2013-05-06The Journal of Physical Chemistry C

We perform ab initio calculations that indicate that the relative stability of antiphase boundaries (APBs) with armchair and zigzag chiralities in monolayer boron nitride (BN) is strongly dependent on the chemical potentials of boron (B) and nitrogen (N) in the synthesis process. For a realistic interval of chemical p…

Graphene research and applications2D Materials and ApplicationsMolecular Junctions and Nanostructures

Material properties and modeling characteristics for MnFeP1−xAsx materials for application in magnetic refrigeration

Kurt Engelbrecht、K. Nielsen、C.R.H. Bahl 等 5 位作者2013-05-06Journal of Applied Physics

Compounds of MnFeP1−xAsx have received attention recently for their use in active magnetic regenerators (AMR) because of their relatively high isothermal entropy change and adiabatic temperature change with magnetization. However, the materials also generally exhibit a significant magnetic and thermal hysteresis, and…

Magnetic and transport properties of perovskites and related materialsShape Memory Alloy TransformationsAdvanced Condensed Matter Physics

Mixed variational principles and robust finite element implementations of gradient plasticity at small strains

Christian Miehé、Fadi Aldakheel、Steffen Mauthe2013-05-06International Journal for Numerical Methods in Engineering

SUMMARY This work outlines a theoretical and computational framework of gradient plasticity based on a rigorous exploitation of mixed variational principles . In contrast to classical local approaches to plasticity based on locally evolving internal variables, order parameter fields are taken into account governed by…

Microstructure and mechanical propertiesComposite Structure Analysis and OptimizationNonlocal and gradient elasticity in micro/nano structures

New Insight into Intermediate Precursors of Brust–Schiffrin Gold Nanoparticles Synthesis

Lili Zhu、Chen Zhang、Chengchen Guo 等 8 位作者2013-05-06The Journal of Physical Chemistry C

There is an ongoing intensive debate on the mechanism of gold nanoparticles formation regarding the intermediate precursors prior to the addition of reducing agent. A new detailed view of the widely used Brust–Schiffrin two-phase method to prepare gold nanoparticles is presented here. Precursor species of these reacti…

Gold and Silver Nanoparticles Synthesis and ApplicationsNanocluster Synthesis and ApplicationsAdvanced Nanomaterials in Catalysis

Thioamides: Versatile Bonds To Induce Directional and Cooperative Hydrogen Bonding in Supramolecular Polymers

Tristan Mes、Seda Cantekin、Dirk W. R. Balkenende 等 9 位作者2013-05-06Chemistry - A European Journal

The amide bond is a versatile functional group and its directional hydrogen-bonding capabilities are widely applied in, for example, supramolecular chemistry. The potential of the thioamide bond, in contrast, is virtually unexplored as a structuring moiety in hydrogen-bonding-based self-assembling systems. We report h…

Crystallography and molecular interactionsSupramolecular Self-Assembly in MaterialsMolecular spectroscopy and chirality

Low-voltage driven ∼1.54 μm electroluminescence from erbium-doped ZnO/p+-Si heterostructured devices: Energy transfer from ZnO host to erbium ions

Yang Yang、Yunpeng Li、Luelue Xiang 等 5 位作者2013-05-06Applied Physics Letters

It is well known that the light emission at ∼1.54 μm falls within the minimum loss window of silica optic fibers for optical communication and is of significance for the silicon-based optoelectronic integration. Herein, we report on erbium (Er)-related electroluminescence (EL) at ∼1.54 μm from Er-doped ZnO (ZnO:Er)/p+…

ZnO doping and propertiesSemiconductor materials and devicesSilicon Nanostructures and Photoluminescence

Incorporation of luminescent CdSe/ZnS core-shell quantum dots and PbS quantum dots into solution-derived chalcogenide glass films

Spencer Novak、Luca Scarpantonio、Jacklyn Novak 等 8 位作者2013-05-06Optical Materials Express

CdSe/ZnS core-shell quantum dots (CSQDs) and PbS quantum dots (QDs) were synthesized using a colloidal method and incorporated into Ge23Sb7S70 glass films via a solution-derived approach to film formation. Photoluminescence (PL) from the QDs inside the glass matrix was observed in the visible (CdSe/ZnS) and near-IR (P…

Quantum Dots Synthesis And PropertiesChalcogenide Semiconductor Thin FilmsPhase-change materials and chalcogenides

Comprehensive investigation of elastic and electrical properties of Li/Ta-modified (K,Na)NbO3 lead-free piezoceramics

Fang‐Zhou Yao、Ke Wang、Jing‐Feng Li2013-05-06Journal of Applied Physics

A full set of elastic and electrical coefficients of (K,Na)NbO3-based lead-free piezoceramics with a nominal composition of Li0.03(K0.48Na0.52)0.97(Nb0.8Ta0.2)O3 (abbreviated as KNNLT) was evaluated by the standard resonance method, and compared to those of K4CuNb8O23 doped (K0.45Na0.55)NbO3 (KNN-KCN) as well as typic…

Ferroelectric and Piezoelectric MaterialsMultiferroics and related materialsAcoustic Wave Resonator Technologies

Mechanical Reinforcement of Polybenzoxazole by Carbon Nanotubes through Noncovalent Functionalization

Takahiro Fukumaru、Tsuyohiko Fujigaya、Naotoshi Nakashima2013-05-06Macromolecules

Polybenzoxazole (PBO) reinforced with carbon nanotubes (CNTs) is of great interest in the field of polymer composites because PBO and CNTs possess the highest-level mechanical properties among polymers and filler materials, respectively. However, the insolubility of PBO and the CNTs makes it difficult to develop a CNT…

Carbon Nanotubes in CompositesPolymer Nanocomposites and PropertiesTribology and Wear Analysis

Graded bandgap structure for PbS/CdS/ZnS quantum-dot-sensitized solar cells with a PbxCd1−xS interlayer

Jongmin Kim、Hongsik Choi、Changwoo Nahm 等 11 位作者2013-05-06Applied Physics Letters

To suppress the electron-hole recombination in the multishell sensitizer for quantum-dot-sensitized solar cells (QDSCs), the PbxCd1−xS interlayer is incorporated between the PbS core and CdS shell. The PbS/PbxCd1−xS/CdS structure enhances the cell efficiency by ∼60% compared to PbS/CdS QDSCs, and consequently shows a…

TiO2 Photocatalysis and Solar CellsAdvanced Photocatalysis TechniquesQuantum Dots Synthesis And Properties

Detailed consideration of the electron-phonon thermal conductance at metal-dielectric interfaces

P. Singh、Myunghoon Seong、Sanjiv Sinha2013-05-06Applied Physics Letters

The effect of electron-phonon coupling on thermal conductance across metal-dielectric interfaces remains inconclusive. The leading model employs the phonon thermal conductivity of the metal that is difficult to estimate. We remove this difficulty by obtaining the conductance directly from the Bloch-Boltzmann-Peierls f…

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

Nanoconfinement and the Strength of Biopolymers

Tristan Giesa、Markus J. Buehler2013-05-06Annual Review of Biophysics

This review examines size effects observed in the mechanical strength of biopolymers that are organized in microstructures such as fibrils, layered composites, or particle nanocomposites. We review the most important aspects that connect nanoconfinement of basic material constituents at critical length scales to the m…

Calcium Carbonate Crystallization and InhibitionAdvanced Materials and MechanicsSilk-based biomaterials and applications

Surface Functionalized Hydrophobic Porous Particles Toward Water Treatment Application

Alireza Abbaspourrad、Nick J. Carroll、Shin‐Hyun Kim 等 4 位作者2013-05-06Advanced Materials

A microfluidic-based approach for the fabrication of organic contaminants absorbing core-shell particles is demonstrated. The hydrophobic porous core absorbs oil while the hydrophilic surface enables the particles to be well-dispersed in aqueous solutions. These particles can uptake oil from aqueous solution saturated…

Surface Modification and SuperhydrophobicityMicrofluidic and Capillary Electrophoresis ApplicationsElectrohydrodynamics and Fluid Dynamics

Tuning the work function of graphene by ultraviolet irradiation

Yow-Jon Lin、Jian-Jhou Zeng2013-05-06Applied Physics Letters

Graphene layers grown by chemical vapor deposition were, respectively, irradiated for 0, 20, 40, and 60 min by an ultraviolet light source in order to experimentally study the change in the work function of graphene. The dependences of the work function and carrier concentration upon ultraviolet irradiation have been…

Carbon Nanotubes in CompositesGraphene research and applicationsGraphene and Nanomaterials Applications

Light-induced electronic non-equilibrium in plasmonic particles

Mordechai Kornbluth、Abraham Nitzan、Tamar Seideman2013-05-06The Journal of Chemical Physics

We consider the transient non-equilibrium electronic distribution that is created in a metal nanoparticle upon plasmon excitation. Following light absorption, the created plasmons decohere within a few femtoseconds, producing uncorrelated electron-hole pairs. The corresponding non-thermal electronic distribution evolv…

Gold and Silver Nanoparticles Synthesis and ApplicationsPlasmonic and Surface Plasmon ResearchThermal Radiation and Cooling Technologies

Orthorhombic In2O3: A Metastable Polymorph of Indium Sesquioxide

Maged F. Bekheet、M. Schwarz、Stefan Lauterbach 等 7 位作者2013-05-06Angewandte Chemie International Edition

The way is open for the physical and chemical characterization and single-crystal growth of the orthorhombic o′-In2O3 polymorph. Orthorhombic In2O3 is synthesized from rhombohedral corundum-type rh-In2O3 under moderately high-pressure and high-temperature conditions (8–9 GPa, 600–1100 °C) followed by recovery to ambie…

ZnO doping and propertiesGas Sensing Nanomaterials and SensorsTransition Metal Oxide Nanomaterials

Applications of gold nanorods in biomedical imaging and related fields

Zhiya Ma、HongXing Xia、Yuping Liu 等 6 位作者2013-05-06Chinese Science Bulletin

Gold nanorods (GNRs) have great potential widespread applications in biomedical imaging, drug delivery and photothermal therapy due to unique surface plasmon resonance (SPR) ranging from visible to near infrared (NIR) region, facile synthesis and easy functionalization. In this review, the recent progress of GNRs in b…

Nanoparticle-Based Drug DeliveryGold and Silver Nanoparticles Synthesis and ApplicationsNanoplatforms for cancer theranostics

Salts drive controllable multilayered upright assembly of amyloid-like peptides at mica/water interface

Bin Dai、Seung-Gu Kang、Tien Huynh 等 8 位作者2013-05-06Proceedings of the National Academy of Sciences

Surface-assisted self-assembly of amyloid-like peptides has received considerable interest in both amyloidosis research and nanotechnology in recent years. Despite extensive studies, some controlling factors, such as salts, are still not well understood, even though it is known that some salts can promote peptide self…

Protein Structure and DynamicsSupramolecular Self-Assembly in MaterialsSurface Chemistry and Catalysis

Ag dendritic nanostructures as ultrastable substrates for surface-enhanced Raman scattering

Yu Fei Chan、Chang Xing Zhang、Zheng Wu 等 7 位作者2013-05-06Applied Physics Letters

Dendritic silver nanostructures coated with silica nanofilm are synthesized via hydrothermal etching using silver nitrate, hydrofluoric acid, and hydrogen peroxide and controlling the reagent concentration, reaction time, and temperature. The silver dendritic nanostructures are employed as substrates for surface-enhan…

Gold and Silver Nanoparticles Synthesis and ApplicationsPlasmonic and Surface Plasmon ResearchNanocluster Synthesis and Applications

Differential Coordination Demands in Fe versus Mn Water-Soluble Cationic Metalloporphyrins Translate into Remarkably Different Aqueous Redox Chemistry and Biology

Artak Tovmasyan、Tin Weitner、Huaxin Sheng 等 10 位作者2013-05-06Inorganic Chemistry

The different biological behavior of cationic Fe and Mn pyridylporphyrins in Escherichia coli and mouse studies prompted us to revisit and compare their chemistry. For that purpose, the series of ortho and meta isomers of Fe(III) meso-tetrakis-N-alkylpyridylporphyrins, alkyl being methyl to n-octyl, were synthesized a…

Porphyrin and Phthalocyanine ChemistryElectrochemical Analysis and ApplicationsMetal-Catalyzed Oxygenation Mechanisms