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Highly Dispersed Surfactant‐Free Nickel Nanoparticles and Their Remarkable Catalytic Activity in the Hydrolysis of Ammonia Borane for Hydrogen Generation

Pei‐Zhou Li、A. Aijaz、Qiang Xü2012-05-24Angewandte Chemie International Edition

Highly active: Surfactant-free Ni nanocatalysts were highly dispersed into the nanoporous carbon support MSC-30 through a dry process, and the obtained Ni@MSC-30 catalyzed the generation of H2 from the hydrolysis of ammonia borane at room temperature (see picture). The improvement of the performance of surfactant-free…

Metal-Organic Frameworks: Synthesis and ApplicationsHydrogen Storage and MaterialsAmmonia Synthesis and Nitrogen Reduction

Derivative discontinuity, bandgap and lowest unoccupied molecular orbital in density functional theory

Weitao Yang、Aron J. Cohen、Paula Mori‐Sánchez2012-05-24The Journal of Chemical Physics

The conventional analysis of Perdew and Levy, and Sham and Schlüter shows that the functional derivative discontinuity of the exchange-correlation density functional plays a critical role in the correct prediction of bandgaps, or the chemical hardness. In a recent work by the present authors, explicit expressions for…

Advanced Chemical Physics StudiesMachine Learning in Materials ScienceInorganic Chemistry and Materials

Nanoparticulate Iron Oxide Tubes from Microporous Organic Nanotubes as Stable Anode Materials for Lithium Ion Batteries

Narae Kang、Ji Hoon Park、Jaewon Choi 等 11 位作者2012-05-24Angewandte Chemie International Edition

Tubes from tubes: Microporous organic nanotubes were prepared by Sonogashira coupling between tetrakis(4-ethynylphenyl)methane and N,N′-di(4-iodophenyl)-4,4′-bipyridinium dichloride. These nanotubes were used as a template for secondary inorganic materials, namely Fe2O3 nanotubes with a high discharge capacity and exc…

Advancements in Battery MaterialsMetal-Organic Frameworks: Synthesis and ApplicationsCovalent Organic Framework Applications

Mechanical properties of polycrystalline graphene based on a realistic atomistic model

Jani Kotakoski、Jannik C. Meyer2012-05-24Physical Review B

Graphene can at present be grown at large quantities only by the chemical vapor deposition method, which produces polycrystalline samples. Here, we describe a method for constructing realistic polycrystalline graphene samples for atomistic simulations, and apply it for studying their mechanical properties. We show tha…

Graphene research and applicationsDiamond and Carbon-based Materials ResearchNanopore and Nanochannel Transport Studies

Behavior of oxygen vacancies in single-crystal SrTiO3: Equilibrium distribution and diffusion kinetics

Roger A. De Souza、Veronika Metlenko、Daesung Park 等 4 位作者2012-05-24Physical Review B

${}^{18}$O/${}^{16}$O exchange and subsequent time-of-flight secondary ion mass spectrometry (ToF-SIMS) analysis was employed to investigate the transport of oxygen, and thus the behavior of oxygen vacancies, in [nominally undoped, (100) oriented] single-crystal SrTiO${}_{3}$ substrates. Isotope exchange anneals were…

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

Electronic Structure and Exciton–Phonon Interaction in Two-Dimensional Colloidal CdSe Nanosheets

Alexander W. Achtstein、A. Schliwa、Anatol Prudnikau 等 7 位作者2012-05-24Nano Letters

We study the electronic structure of ultrathin zinc-blende two-dimensional (2D)-CdSe nanosheets both theoretically, by Hartree-renormalized k·p calculations including Coulomb interaction, and experimentally, by temperature-dependent and time-resolved photoluminescence measurements. The observed 2D-heavy hole exciton s…

Quantum Dots Synthesis And PropertiesChalcogenide Semiconductor Thin FilmsNonlinear Optical Materials Studies

Heavy Doping and Band Engineering by Potassium to Improve the Thermoelectric Figure of Merit in p-Type PbTe, PbSe, and PbTe1–ySey

Qian Zhang、Feng Cao、Weishu Liu 等 10 位作者2012-05-24OpenAlex

We present detailed studies of potassium doping in PbTe(1-y)Se(y) (y = 0, 0.15, 0.25, 0.75, 0.85, 0.95, and 1). It was found that Se increases the doping concentration of K in PbTe as a result of the balance of electronegativity and also lowers the lattice thermal conductivity because of the increased number of point…

Advanced Thermoelectric Materials and DevicesChalcogenide Semiconductor Thin FilmsThermal Expansion and Ionic Conductivity

Linking Crystallographic Model and Data Quality

P. Andrew Karplus、Kay Diederichs2012-05-24OpenAlex

Finessing Crystal Analysis Protein crystallography has revolutionized our understanding of a whole variety of biological processes (see the Perspective by Evans ). In crystallography, the measure of agreement between the data and the calculated model is not on the same scale as the measure of data quality, making it c…

Protein Structure and DynamicsRNA and protein synthesis mechanismsEnzyme Structure and Function

Innenrücktitelbild: One‐Pot Controlled Synthesis of Hexagonal‐Prismatic Cu1.94S‐ZnS, Cu1.94S‐ZnS‐Cu1.94S, and Cu1.94S‐ZnS‐Cu1.94S‐ZnS‐Cu1.94S Heteronanostructures (Angew. Chem. 26/2012)

Shikui Han、Ming Gong、Hong‐Bin Yao 等 5 位作者2012-05-23Angewandte Chemie

Hexagonal-prismatische Cu1.94S-ZnS-, Cu1.94S-ZnS-Cu1.94S- und Cu1.94S-ZnS-Cu1.94S-ZnS-Cu1.94S-Nanostrukturen können mit schrauben-, hantel- und sandwichartigen Formen hergestellt werden. In der Zuschrift auf S. 6471 ff. zeigen S.-H. Yu et al., dass der Produkttyp über das Molverhältnis der Vorstufen CuI und [Zn(S2CNEt…

Quantum Dots Synthesis And PropertiesChalcogenide Semiconductor Thin FilmsCopper-based nanomaterials and applications

Comment on “Uncovering the Complex Behavior of Hydrogen in Cu2O ”

Koushik Biswas、Mao‐Hua Du、Jiraroj T‐Thienprasert 等 5 位作者2012-05-23Physical Review Letters

A Comment on the Letter by David O. Scanlon and Graeme W. Watson, Phys. Rev. Lett. 106, 186403 (2011). The authors of the Letter offer a Reply.Received 15 July 2011DOI:https://doi.org/10.1103/PhysRevLett.108.219703© 2012 American Physical Society

Physics of Superconductivity and MagnetismZnO doping and propertiesCopper-based nanomaterials and applications

An analysis of the radiation field characteristics for extremity dose assessment during maintenanceperiods at nuclear power plants in Korea

H. G. Kim、Tae Young Kong2012-05-23Radiation Protection Dosimetry

Workers who maintain the water chambers of steam generators during maintenance periods in nuclear power plants (NPPs) have a higher likelihood of high radiation exposure, even if they are exposed for a short period of time. In particular, it is expected that the hands of workers would receive the highest radiation exp…

Radiation Dose and ImagingRadiation Detection and Scintillator TechnologiesGraphite, nuclear technology, radiation studies

Overpotential Behavior of Carbon Monoxide Fuel in a Molten Carbonate Fuel Cell

C.‐G. Lee2012-05-23Fuel Cells

Abstract The overpotential of carbon monoxide (CO) fuel was analyzed with a 100‐cm 2 class molten carbonate fuel cell. The overpotential at the anode was measured using the steady state polarization, inert gas step addition, and reactant gas addition methods. Then, the overpotential was compared between normal hydroge…

Electrocatalysts for Energy ConversionAdvancements in Solid Oxide Fuel CellsFuel Cells and Related Materials

Optimisation of microwave absorption of carbon nanotube composites through use of carboxyl-epoxide functional group linkages

Paul Theilmann、Kunmo Chu、Prabhakar R. Bandaru 等 5 位作者2012-05-23Electronics Letters

Lightweight, flexible and highly efficient microwave absorbing single-walled carbon nanotube (SWNT)/polymer composites were fabricated through chemical functionalisation to ensure uniform dispersion of SWNTs in a polymer matrix. These composites were used to fabricate thin electromagnetic absorption coatings, which ac…

Natural Fiber Reinforced CompositesElectromagnetic wave absorption materialsAdvanced Antenna and Metasurface Technologies

Spiral shape CNT on silicon substrate growth control method for on-chip electronic devices applications

Jaber A. Abu Qahouq、David Carnahan2012-05-23Electronics Letters

Carbon nanotubes (CNTs) with their different types have several potential future applications, including on-chip integrated electronic devices. The growth control of CNTs in the desired shape is important to realise such devices. A method to control the growth of CNTs in a desired spiral shape or other similar shapes…

Carbon Nanotubes in CompositesNanowire Synthesis and ApplicationsNanotechnology research and applications

Spray pyrolysis prepared yellow to red color tunable Sr_1-xCa_xSe:Eu^2+ phosphors for white LED

Wonkeun Chung、Hyunchul Jung、Chang Hun Lee 等 5 位作者2012-05-23Optics Express

The spherical and submicron size of Sr₁-xCaxSe:Eu²⁺ phosphors were successfully prepared by ultrasonic spray pyrolysis. The phosphors adopted a cubic structure, and the replacement of Sr²⁺ with Ca²⁺ decreased the lattice parameter. The Sr₁-xCaxSe:Eu²⁺ showed broad and strong excitation under 420-460 nm blue light, and…

Advanced Photocatalysis TechniquesLuminescence Properties of Advanced MaterialsQuantum Dots Synthesis And Properties

Observation of Bunched Blinking from Individual CdSe/CdS and CdSe/ZnS Colloidal Quantum Dots

Haiyan Qin、Xiaoying Shang、Zhijun Ning 等 8 位作者2012-05-23The Journal of Physical Chemistry C

Blinking and time correlation between fluorescences of neighboring negatively charged CdSe/CdS and CdSe/ZnS colloidal quantum dots have been studied experimentally. A tendency of synchronous blinking, that is, a bunching effect, is clearly observed from two neighboring QDs with a spatial separation up to 1.1 μm. We be…

Quantum Dots Synthesis And PropertiesChalcogenide Semiconductor Thin FilmsNear-Field Optical Microscopy

The formation of asymmetric polystyrene/saponite composite nanoparticles via miniemulsion polymerization

Zhaohui Tong、Yulin Deng2012-05-23Journal of Applied Polymer Science

Abstract The synthesis of asymmetric spherical nanoparticles has attracted great interest because their anisotropic structure can be used as unique building blocks for constructing advanced materials. In this article, we report the formation of hemispherical or truncated polystyrene/nanosaponite composite particles vi…

Advanced Polymer Synthesis and CharacterizationPolymer Nanocomposites and PropertiesPickering emulsions and particle stabilization

Thermal and flammability studies of poly(vinyl alcohol) composites filled with sodium hydroxide

Sanjiv Arora、Mahender Kumar、Mahesh Kumar2012-05-23Journal of Applied Polymer Science

Abstract Poly(vinyl alcohol) (PVA) is a polymer of great value due to its wide spread applications. The present article describes the effect of sodium hydroxide on the flammability, thermal degradation, and tensile strength properties of PVA. The PVA/sodium hydroxide composite films at different loading levels of sodi…

Polymer Nanocomposites and PropertiesFlame retardant materials and propertiesPolymer Nanocomposite Synthesis and Irradiation

Computational design of improved two‐photon active caging compounds based on nitrodibenzofuran

Andreas Dreuw、Matthias Polkehn、Robert Binder 等 5 位作者2012-05-23Journal of Computational Chemistry

Nitrodibenzofuran (NDBF) has recently been established as photolabile protecting group and efficiently used as two-photon active cage. In this work, a computational approach is exploited to rationally design improved two-photon active caging groups based on this NDBF chromophore. For this objective, first the two-phot…

Porphyrin and Phthalocyanine ChemistryPhotochromic and Fluorescence ChemistryNonlinear Optical Materials Studies

Analysis of the dielectric spectroscopy of an epoxy‐ZnO nanocomposite using the universal relaxation law

Wenhu Yang、Ran Yi、Sisi Hui 等 5 位作者2012-05-23Journal of Applied Polymer Science

Abstract There is currently no unified theory that explains the role of nanofillers in polymeric insulation. Consequently, different methods such as dielectric spectroscopy analysis are used to understand this role. The existence of a strong interaction between nanoparticles and a polymer is widely accepted. However,…

Polymer Nanocomposites and PropertiesHigh voltage insulation and dielectric phenomenaDielectric materials and actuators