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Evolution of diffraction methods for solving crystal structures

Wayne A. Hendrickson2012-12-18Acta Crystallographica Section A Foundations of Crystallography

The discovery of X-ray diffraction in 1912 by Laue and co-workers had important implications for the physics of diffraction, for the nature of X-radiation and for the structure of matter. Lawrence Bragg made important contributions to early developments in each of these areas, but the most pregnant of his innovations…

Protein Structure and DynamicsRNA and protein synthesis mechanismsEnzyme Structure and Function

Unraveling the Atomic Structure of Ultrafine Iron Clusters

Hongtao Wang、Kun Li、Yingbang Yao 等 8 位作者2012-12-18Scientific Reports

Unraveling the atomic structures of ultrafine iron clusters is critical to understanding their size-dependent catalytic effects and electronic properties. Here, we describe the stable close-packed structure of ultrafine Fe clusters for the first time, thanks to the superior properties of graphene, including the monola…

Advanced Chemical Physics StudiesGraphene research and applicationsCatalytic Processes in Materials Science

Dual-emitting nanocomposites derived from rare-earth compound nanotubes for ratiometric fluorescence sensing applications

Tianying Sun、Daquan Zhang、Xue‐Feng Yu 等 9 位作者2012-12-18Nanoscale

A new class of ratiometric fluorescence sensors composed of rare-earth (RE) compound nanotubes is described. Polyethylenimine-coated yttrium hydroxide fluoride nanotubes (YHF NTs) that were synthesized hydrothermally exhibit highly efficient fluorescence when doped with RE ions. The polyethylenimine on the NTs facilit…

Luminescence Properties of Advanced MaterialsLuminescence and Fluorescent MaterialsAnalytical Chemistry and Sensors

Celebrating 100 years of X-ray crystallography

S. Wilkins2012-12-18Acta Crystallographica Section A Foundations of Crystallography

marks the centenary of the reading of the paper by William Lawrence Bragg (WLB) to the Cambridge Philosophical Society outlining the foundations of X-ray crystallography. It included the derivation of the first correct atomic structure of a crystal, namely that of zinc blende, based on the X-ray diffraction pattern re…

Enzyme Structure and FunctionAdvanced X-ray Imaging TechniquesCrystallography and Radiation Phenomena

Preparation and Characterization of Light-Sensitive Microcapsules Based on a Liquid Crystalline Polyester

Krzysztof Artur Bogdanowicz、Bartosz Tylkowski、Marta Giamberini2012-12-18Langmuir

Photosensitive microcapsules and membranes based on poly(α-methylstilbenesebacoate-co-α-methylstilbeneisophthalate), containing the photosensitive α-methylstilbene moiety, were prepared by a phase-inversion precipitation process. In order to simulate the morphology and behavior of the microcapsule shell under UV irrad…

Liquid Crystal Research AdvancementsPhotochromic and Fluorescence ChemistryPhotopolymerization techniques and applications

pH‐Responsive Drug Delivery by Amphiphilic Copolymer through Boronate–Catechol Complexation

Suhong Wu、Ruogu Qi、Huihui Kuang 等 7 位作者2012-12-18ChemPlusChem

Abstract Stimuli‐responsive micellar nanoparticles are gaining considerable attention in the field of drug delivery because of their great advantages of high efficiency in tumor accumulation through the enhanced permeability and retention effect and rapid drug release. In this study, a novel catechol moiety‐containing…

Nanoparticle-Based Drug DeliveryDendrimers and Hyperbranched PolymersBoron Compounds in Chemistry

Mechanical and crystalline properties of monomer casting Nylon‐6/Sio2 composites prepared via in situ polymerization

Sheng Xu、Xiaowen Zhao、Lin Ye2012-12-18Polymer Engineering and Science

Abstract A series of monomer casting (MC) nylon‐6/SiO 2 composites were prepared via in situ polymerization. It was found that the tensile strength, storage modulus, and notched charpy impact strength of the composites were improved and reached maximum at 3–5 wt% loading of SiO 2 . The α relaxation peak corresponding…

Polymer crystallization and propertiesPolymer Nanocomposites and Propertiesbiodegradable polymer synthesis and properties

Temperature Dependence of the Johari–Goldstein Relaxation in Poly(methyl methacrylate) and Poly(thiomethyl methacrylate)

R. Casalini、Arthur W. Snow、C. M. Roland2012-12-18Macromolecules

To analyze the Johari–Goldstein (JG) secondary process, dielectric relaxation measurements were carried out on poly(methyl methacrylate) (PMMA) and poly(thiomethyl methacrylate) (PTMA). The latter has a sulfur atom replacing the oxygen in the ester of PMMA, making the pendant group much less polar. This weakens the in…

Material Dynamics and PropertiesConducting polymers and applicationsPhotochemistry and Electron Transfer Studies

Silber als antibakterielles Agens: Ion, Nanopartikel, Metall

Svitlana Chernousova、Matthias Epple2012-12-18Angewandte Chemie

Abstract Die antibakterielle Wirkung von Silber wird in zahlreichen Haushalts‐ und Medizinprodukten genutzt. Dabei kommen außer Beschichtungen aus metallischem Silber auch Silbersalze und zunehmend auch Silber‐Nanopartikel zum Einsatz. Der Stand der Forschung zur Wirkung von Silber auf Bakterien, Zellen und höhere Org…

Nanoparticles: synthesis and applicationsHeavy Metal Exposure and ToxicityElectrochemical Analysis and Applications

Mesoporous materials for antihydrogen production

Giovanni Consolati、R. Ferragut、Anne Galarneau 等 5 位作者2012-12-18Chemical Society Reviews

Antimatter is barely known by the chemist community and this article has the vocation to explain how antimatter, in particular antihydrogen, can be obtained, as well as to show how mesoporous materials could be used as a further improvement for the production of antimatter at very low temperatures (below 1 K). The fir…

Supercapacitor Materials and FabricationMesoporous Materials and CatalysisAerogels and thermal insulation

Application of a quantitative weight of evidence approach for ranking and prioritising occupational exposure scenarios for titanium dioxide and carbon nanomaterials

Danail Hristozov、Stefania Gottardo、Marco Cinelli 等 9 位作者2012-12-18Nanotoxicology

Substantial limitations and uncertainties hinder the exposure assessment of engineered nanomaterials (ENMs). The present deficit of reliable measurements and models will inevitably lead in the near term to qualitative and uncertain exposure estimations, which may fail to support adequate risk assessment and management…

Nanoparticles: synthesis and applicationsAir Quality and Health ImpactsChemical Safety and Risk Management

Porphyrin nanotubes composed of highly ordered molecular arrays prepared by anodic aluminum template method

Qingyun Liu、Ji-Qin Zhu、Tao Sun 等 8 位作者2012-12-18RSC Advances

Nanotubes of metal-free 5,10,15,20-tetrakis(4-chlorophenyl)porphyrin (H2TClPP) are fabricated by using nanoporous anodized aluminum oxide (AAO) membrane as the template. The morphology and structure of the nanotubes are investigated by using transmission electron microscopy (TEM) and field emission scanning electron m…

Porphyrin and Phthalocyanine ChemistrySupramolecular Self-Assembly in MaterialsNanopore and Nanochannel Transport Studies

Electronic and EPR spectra of the species involved in [W10O32]4− photocatalysis. A relativistic DFT investigation

Davide Ravelli、Daniele Dondi、Maurizio Fagnoni 等 5 位作者2012-12-18Physical Chemistry Chemical Physics

The decatungstate anion [W(10)O(32)](4-) is widely used as a photocatalyst in different transformations, during which it undergoes one-electron reduction to [W(10)O(32)](5-), possibly protonated; the bi-reduced species [W(10)O(32)](6-) is obtained by ensuing disproportionation. Relativistic DFT calculations were used…

Porphyrin and Phthalocyanine ChemistryPolyoxometalates: Synthesis and ApplicationsVanadium and Halogenation Chemistry

Luminescence and scintillation mechanism in Ce3+ and Pr3+ doped (Lu,Y,Gd)3(Ga,Al)5O12 single crystal scintillators

M. Nikl、Kei Kamada、Shunsuke Kurosawa 等 7 位作者2012-12-18Physica status solidi. C, Conferences and critical reviews/Physica status solidi. C, Current topics in solid state physics

Abstract Luminescence processes occurring in the 5d 1 excited state of Ce 3+ and Pr 3+ centers in the (Gd,RE) 3 (Ga,Al) 5 O 12 , RE=Lu,Y, multicomponent garnet host were studied by purely optical contactless methods. Combination of measurements of the prompt nanosecond decay and slow delayed radiative recombination de…

Luminescence Properties of Advanced MaterialsRadiation Detection and Scintillator TechnologiesLanthanide and Transition Metal Complexes

Synthesis and properties of highly hydrophilic waterborne polyurethane‐ureas containing various hardener content for waterproof breathable fabrics

Eun Young Kim、Jung‐Hee Lee、Dong‐Jin Lee 等 6 位作者2012-12-18Journal of Applied Polymer Science

Abstract As part of an ongoing search for highly hydrophilic waterborne polyurethanes for waterproof breathable fabrics, a waterborne polyurethane [waterborne polyurethane‐ureas (WBPU): P70, the number indicates the poly(ethylene glycol) (PEG) content] dispersion was synthesized from PEG (70 wt %) and dimethylol propi…

Polymer Nanocomposites and PropertiesPolymer composites and self-healingFlame retardant materials and properties

Low temperature synthesis and SERS application of silver molybdenum oxides

Essy Kouadio Fodjo、Dawei Li、Niamien Paulin Marius 等 5 位作者2012-12-18Journal of Materials Chemistry A

AgxMoyOz (Ag/α-MoO3, Ag/h-MoO3, Ag/β-MoO3, Ag2Mo2O7, and Ag2MoO4) nanomaterials are synthesized at relatively low temperature (80 °C) and with a short hydrothermal treatment time (3 h) using glucose (Glc) as a catalyst. Contrary to previous studies, it is possible to synthesize one of the AgxMoyOz binaries at 80 °C by…

Gold and Silver Nanoparticles Synthesis and ApplicationsCopper-based nanomaterials and applicationsNanocluster Synthesis and Applications

Toxicity and biodistribution of aqueous synthesized ZnS and ZnO quantum dots in mice

Yanjie Yang、Jingfeng Lan、Zhigang Xu 等 9 位作者2012-12-18Nanotoxicology

In the present study, ZnS and ZnO quantum dots (QDs) were synthesized via an all-aqueous process with polyethylene glycol (PEG) chains on their surface, and their toxicity as well as biodistribution were evaluated. No haemolysis occurred at a high concentration of 1600 µg/mL in vitro haemolytic assay, which demonstrat…

Nanoparticle-Based Drug DeliveryQuantum Dots Synthesis And PropertiesAdvanced Drug Delivery Systems

Self-assembly of double helical nanostructures inside carbon nanotubes

Cheng Lv、Qingzhong Xue、Meixia Shan 等 9 位作者2012-12-18Nanoscale

We use molecular dynamics (MD) simulations to show that a DNA-like double helix of two poly(acetylene) (PA) chains can form inside single-walled carbon nanotubes (SWNTs). The computational results indicate that SWNTs can activate and guide the self-assembly of polymer chains, allowing them to adopt a helical configura…

Carbon Nanotubes in CompositesGraphene research and applicationsNanopore and Nanochannel Transport Studies

Topology Switching in [32]Heptaphyrins Controlled by Solvent, Protonation, and meso Substituents

Mercedes Alonso、Paul Geerlings、Frank De Proft2012-12-18Chemistry - A European Journal

The switching of topology between "figure-eight", Möbius, and untwisted conformations in [32]heptaphyrins(1.1.1.1.1.1.1) has been investigated by using density functional theory calculations. Such a change is achieved by variation of one internal dihedral angle and, if properly controlled, can provide access to molecu…

Supramolecular Chemistry and ComplexesPorphyrin and Phthalocyanine ChemistrySynthesis and Properties of Aromatic Compounds

Preparation of Raspberry-like Polymer Particles by a Heterocoagulation Technique Utilizing Hydrogen Bonding Interactions between Steric Stabilizers

Hideto Minami、Yusuke Mizuta、Toyoko Suzuki2012-12-18Langmuir

Large polystyrene particles stabilized by poly(acrylic acid) (PAA) (L-PS(PAA)) (as the core) and small polystyrene particles stabilized by poly(vinyl pyrrolidone) (PVP) (S-PS(PVP)) (as the corona) were successfully used to prepare raspberry-like particles by a heterocoagulation technique utilizing the hydrogen bonding…

Advanced Polymer Synthesis and CharacterizationPolymer Surface Interaction StudiesPickering emulsions and particle stabilization