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How Does the Axial Ligand of Cytochrome P450 Biomimetics Influence the Regioselectivity of Aliphatic versus Aromatic Hydroxylation?

Sam P. de Visser、Laleh Tahsini、Wonwoo Nam2009-04-03Chemistry - A European Journal

Abstract How deep is your orbital? Density functional theory studies on the axial ligand effect of aliphatic versus aromatic hydroxylation of ethylbenzene by iron–oxo complexes with a variable axial ligand show that strong (anionic) ligands pull the metal inside the plane of the haeme and destabilise cationic intermed…

Porphyrin and Phthalocyanine ChemistryMetal-Catalyzed Oxygenation MechanismsPorphyrin Metabolism and Disorders

Interface Structures of Gold Nanoparticles on TiO2 (110)

Naoya Shibata、Akira Gotō、Katsuyuki Matsunaga 等 7 位作者2009-04-03Physical Review Letters

Scanning transmission electron microscopy and density functional theory are used to characterize atomic structures of nanoscale heterointerfaces between gold nanoparticles and a TiO2 (110) surface. It is found that when the gold nanoparticle size is smaller than a few nanometers, gold atoms preferentially attach to sp…

Catalytic Processes in Materials Sciencenanoparticles nucleation surface interactionsChemical and Physical Properties of Materials

Assessing Surface Permeabilities from Transient Guest Profiles in Nanoporous Host Materials

Despina Tzoulaki、Lars Heinke、Hyuna Lim 等 9 位作者2009-04-03Angewandte Chemie International Edition

Easy come, easy go? Transport resistances on particle surfaces are important for mass transfer in nanoporous materials and bulk diffusion in crystals. Interference microscopy and IR micro-imaging are shown to be excellent tools for determining such transport resistances. By studying short-chain-length alkane guest mol…

Metal-Organic Frameworks: Synthesis and ApplicationsCrystallography and molecular interactionsX-ray Diffraction in Crystallography

Compressed ion temperature gradient turbulence in diverted tokamak edge

C. S. Chang、S. Ku、P. H. Diamond 等 7 位作者2009-04-03Physics of Plasmas

It is found from a heat-flux-driven full-f gyrokinetic particle simulation that there is ion temperature gradient (ITG) turbulence across an entire L-mode-like edge density pedestal in a diverted tokamak plasma in which the ion temperature gradient is mild without a pedestal structure, hence the normalized ion tempera…

Ionosphere and magnetosphere dynamicsMagnetic confinement fusion researchFusion materials and technologies

Colloquium : Electron-lattice interaction and its impact on high T c superconductivity

Vladimir Z. Kresin、Stefan Wolf2009-04-03Reviews of Modern Physics

In this Colloquium, the main features of the electron-lattice interaction are discussed and high values of the critical temperature up to room temperature could be provided. While the issue of the mechanism of superconductivity in the high ${T}_{c}$ cuprates continues to be controversial, one can state that there have…

Physics of Superconductivity and MagnetismMagnetic and transport properties of perovskites and related materialsSuperconductivity in MgB2 and Alloys

Electric-field control of surface magnetic anisotropy: a density functional approach

Hongbin Zhang、Manuel Richter、Klaus Koepernik 等 6 位作者2009-04-03New Journal of Physics

In a recent experiment, Weisheit et al (2007 Science 315 349) demonstrated that the coercivity of thin L1 0 FePt and FePd films can be modified by the external electric field in an electrochemical environment.Here, this observation is confirmed by density functional calculations for the intrinsic magnetic anisotropy.T…

Physics of Superconductivity and MagnetismMagnetic properties of thin filmsMagnetic Properties and Applications

Biologically inspired rosette nanotubes and nanocrystalline hydroxyapatite hydrogel nanocomposites as improved bone substitutes

Lijie Grace Zhang、José A. Rodríguez、Jose Raez 等 6 位作者2009-04-03Nanotechnology

Today, bone diseases such as bone fractures, osteoporosis and bone cancer represent a common and significant public health problem. The design of biomimetic bone tissue engineering materials that could restore and improve damaged bone tissues provides exciting opportunities to solve the numerous problems associated wi…

Bone Tissue Engineering MaterialsHydrogels: synthesis, properties, applicationsCollagen: Extraction and Characterization

FLEXIQuant: A Novel Tool for the Absolute Quantification of Proteins, and the Simultaneous Identification and Quantification of Potentially Modified Peptides

Sasha A. Singh、Michael Springer、Judith A. Steen 等 5 位作者2009-04-03Journal of Proteome Research

Measurements of protein abundance and quantitative assessment of multiple post-translational modifications (PTMs) within a single protein are increasingly used to understand the control of protein activity, particularly in metazoan cells. General methods of wide applicability and precision/accuracy for quantitative es…

Advanced Proteomics Techniques and ApplicationsMass Spectrometry Techniques and ApplicationsEnzyme Structure and Function

Nonlinear current-voltage characteristics of nanochannels

Gilad Yossifon、Peter C. Mushenheim、Yu-Chen Chang 等 4 位作者2009-04-03Physical Review E

Like ion channels, nanochannels are known to exhibit curious non-Ohmic current-voltage (I-V) characteristics with an approximate piece-wise constant differential resistance. Using a nanoslot model and a nonequilibrium ion transport theory, we attribute the nonlinear resistance to overlapping double layers inside and a…

Carbon Nanotubes in CompositesFuel Cells and Related MaterialsNanopore and Nanochannel Transport Studies

Wurtzite−Chalcopyrite Polytypism in CuInS2 Nanodisks

Bonil Koo、Reken N. Patel、Brian A. Korgel2009-04-03Chemistry of Materials

Monodisperse CuInS 2 nanodisks were synthesized by heating metal chlorides and thiourea in oleylamine. X-ray diffraction showed the predominant phase to be wurtzite (hexagonal) CuInS 2 instead of chalcopyrite (tetragonal) or compositionally disordered sphalerite (cubic). High-resolution transmission electron microscop…

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

Modelling the response function of energy dispersive X‐ray spectrometers with silicon detectors

Frank Scholze、M. Procop2009-04-03X-Ray Spectrometry

Abstract A new, analytical description of the physical processes determining the spectral response of an energy dispersive X‐ray spectrometer with a silicon detector (Si(Li) or silicon drift detector (SDD)) is presented. The model considers the detector statistical noise, the electronic noise, the incomplete charge co…

X-ray Spectroscopy and Fluorescence AnalysisNuclear Physics and ApplicationsElectron and X-Ray Spectroscopy Techniques

Photocatalytic Hydrogen Evolution from Hexaniobate Nanoscrolls and Calcium Niobate Nanosheets Sensitized by Ruthenium(II) Bipyridyl Complexes

Kazuhiko Maeda、Miharu Eguchi、Seung-Hyun Anna Lee 等 6 位作者2009-04-03The Journal of Physical Chemistry C

Hexaniobate nanoscrolls (NS-H 4 Nb 6 O 17 ) and acid-restacked calcium niobate nanosheets (R-HCa 2 Nb 3 O 10 ) were compared as oxide semiconductors in photocatalytic assemblies for H 2 production using ethylenediaminetetraacetic acid (EDTA) as a sacrificial electron donor and platinum (Pt) nanoparticles as catalysts.…

Advanced Photocatalysis TechniquesPerovskite Materials and ApplicationsPolyoxometalates: Synthesis and Applications

A Fluorescence Turn-on Detection of Cyanide in Aqueous Solution Based on the Aggregation-Induced Emission

Lihua Peng、Ming Wang、Guanxin Zhang 等 5 位作者2009-04-03Organic Letters

The nucleophilic addition of cyanide to the trifluoroacetylamino group in 2 yields an amphiphilic species which would induce the aggregation of silole 1, and as a result, the fluorescence of the ensemble increases largely. Accordingly, a fluorescence turn-on detection of cyanide in aqueous solution can be established…

Molecular Sensors and Ion DetectionLuminescence and Fluorescent MaterialsSulfur Compounds in Biology

Human CD133 + Progenitor Cells Promote the Healing of Diabetic Ischemic Ulcers by Paracrine Stimulation of Angiogenesis and Activation of Wnt Signaling

Lucíola S. Barcelos、Cécile Duplàa、Nicolle Kränkel 等 17 位作者2009-04-03Circulation Research

We evaluated the healing potential of human fetal aorta-derived CD133(+) progenitor cells and their conditioned medium (CD133(+) CCM) in a new model of ischemic diabetic ulcer. Streptozotocin-induced diabetic mice underwent bilateral limb ischemia and wounding. One wound was covered with collagen containing 2x10(4) CD…

Mesenchymal stem cell researchElectrospun Nanofibers in Biomedical ApplicationsWound Healing and Treatments

Two-dimensional IR spectroscopy and isotope labeling defines the pathway of amyloid formation with residue-specific resolution

Sang‐Hee Shim、Ruchi Gupta、Yun L. Ling 等 6 位作者2009-04-03Proceedings of the National Academy of Sciences

There is considerable interest in uncovering the pathway of amyloid formation because the toxic properties of amyloid likely stems from prefibril intermediates and not the fully formed fibrils. Using a recently invented method of collecting 2-dimensional infrared spectra and site-specific isotope labeling, we have mea…

Protein Structure and DynamicsAlzheimer's disease research and treatmentsEnzyme Structure and Function

Macroscopic quantum effects generated by acoustic waves in a molecular magnet

Gwang-Hee Kim、Eugene M. Chudnovsky2009-04-03Physical Review B

We have shown that the size of the magnetization step due to resonant spin tunneling in a molecular magnet can be strongly affected by sound. The transverse-acoustic wave can also generate macroscopic quantum beats of the magnetization during the field sweep.

Magnetism in coordination complexesLanthanide and Transition Metal ComplexesElectron Spin Resonance Studies

Spectroscopic study of NH-tautomerism in novel cycloketo-tetraphenylporphyrins

Eugeny Ermilov、Bettina Büge、Stefan Jasinski 等 5 位作者2009-04-03The Journal of Chemical Physics

The NH-tautomerism is a fundamental property of all metal-free porphyrins. In the present study it was investigated for three novel nonsymmetrical cycloketo-tetraphenylporphyrins in isotropic solutions. The combination of steady-state absorption and fluorescence techniques with decay-associated fluorescence spectrosco…

Porphyrin and Phthalocyanine ChemistryPhotodynamic Therapy Research StudiesPhotochemistry and Electron Transfer Studies

Structure Transition of CuOX Nanoparticles in Copper−Silica Nanocomposites

Qingjie Yu、Xuehu Ma、Zhong Lan 等 5 位作者2009-04-03The Journal of Physical Chemistry C

Two series of CuO X /SiO 2 nanocomposites with various Cu/Si molar ratios have been synthesized by sol−gel technique from two different copper metal precursors, cupric nitrate hydrate (Cu(NO 3 ) 2 ·3H 2 O) and cupric acetylacetonate (Cu(acac) 2 ), respectively. The influence of various chemical precursors and Cu conte…

ZnO doping and propertiesCopper-based nanomaterials and applicationsNanomaterials for catalytic reactions

Silsesquioxane/Polyamine Nanoparticle-Templated Formation of Star- Or Raspberry-Like Silica Nanoparticles

Lucy Kind、Felix A. Plamper、Ronald Göbel 等 8 位作者2009-04-03Langmuir

Silica is an important mineral in biology and technology, and many protocols have been developed for the synthesis of complex silica architectures. The current report shows that silsesquioxane nanoparticles carrying polymer arms on their surface are efficient templates for the fabrication of silica particles with a st…

Surface Modification and SuperhydrophobicitySynthesis and properties of polymersSilicone and Siloxane Chemistry

Structural Changes of Electrodeposited ZnO Matrices for Dye-Sensitized Solar Cells During Preparation

Harald Graaf、Carsten Maedler、Mirko Kehr 等 4 位作者2009-04-03The Journal of Physical Chemistry C

Nanoporous zinc oxide films can be prepared by electrochemical codeposition with the dye eosin Y (EY) as a template and its subsequent desorption with aqueous KOH. In this contribution, the partial dissolving and reorganization of the zinc oxide film during the desorption step was studied in detail using X-ray diffrac…

TiO2 Photocatalysis and Solar CellsZnO doping and propertiesCopper-based nanomaterials and applications