Stefano Fabris、Anthony T. Paxton、Michael W. Finnis2002-06-06arXiv
The microscopic mechanism leading to stabilization of cubic and tetragonal forms of zirconia (ZrO$_2$) is analyzed by means of a self-consistent tight-binding model. Using this model, energies and structures of zirconia containing different vacancy concentrations are calculated, equivalent in concentration to the char…
Materials Science
Wim Wenseleers、Francesco Stellacci、Timo Meyer‐Friedrichsen 等 8 位作者2002-06-06The Journal of Physical Chemistry B
Strong enhancement of the two-photon absorption of organic molecules near silver nanoparticle fractal clusters has been observed and has been exploited to yield composite materials with very strong two-photon absorption and two-photon-excited fluorescence properties. Measurements on cluster films coated with chromopho…
Gold and Silver Nanoparticles Synthesis and ApplicationsNonlinear Optical Materials StudiesNanocluster Synthesis and Applications
Paul A. Liddell、Gerdenis Kodis、Ana L. Moore 等 5 位作者2002-06-06Journal of the American Chemical Society
A dithienylethene (DTE)-porphyrin (P)-fullerene (C(60)) triad molecule in which intramolecular photoinduced electron transfer is controlled by the photochromic DTE moiety has been prepared. Irradiation of the molecule with visible light gives the open form of the dithienylethene (DTEo). Excitation of the porphyrin giv…
Porphyrin and Phthalocyanine ChemistryPhotochemistry and Electron Transfer StudiesPhotochromic and Fluorescence Chemistry
J.J. Sokol、A.G. Hee、Jeffrey R. Long2002-06-06OpenAlex
We report the synthesis of the first well-documented example of a cyano-bridged single-molecule magnet. An assembly reaction parallel to that employed in producing the trigonal prismatic [(Me(3)tacn)(6)MnCr(6)(CN)(18)](2+) (Me(3)tacn = N,N',N"-trimethyl-1,4,7-triazacyclononane) cluster affords K[(Me(3)tacn)(6)MnMo(6)(…
Magnetism in coordination complexesLanthanide and Transition Metal ComplexesAdvanced NMR Techniques and Applications
Peter Reiß、J. Bleuse、Adam Proń2002-06-06OpenAlex
A simple synthetic route for the preparation of high-quality CdSe/ZnSe core/shell nanocrystals without the use of any pyrophoric organometallic precursors is presented. Effective surface passivation of monodisperse CdSe nanocrystals is achieved by overcoating them with a ZnSe shell, applying zinc stearate as a zinc so…
Quantum Dots Synthesis And PropertiesChalcogenide Semiconductor Thin FilmsNanocluster Synthesis and Applications
Youngchang Kim、T. Skarina、Steven Beasley 等 8 位作者2002-06-05Proteins Structure Function and Bioinformatics
The crystal structure of YgbM (EC1530) (Fig. 1), a glyoxylate induced protein from Escherichia coli, has been determined and refined to 1.63 Å by multiple-wavelength anomalous dispersion (MAD) method. YgbM is encoded by DNA bases 2862259–2863035 and belongs to a protein family of Pfam-B_7694.1 The gene is clustered wi…
Protein Structure and DynamicsEnzyme Structure and FunctionEnzyme Production and Characterization
А. Г. Мирочник、E. V. Gukhman、P. A. Zhihareva 等 4 位作者2002-06-05Spectroscopy Letters
Photochemical behavior of polyethylene, polystyrene and polymethylmethacrylate films containing dibenzoylmethanatoboron difluoride was investigated. It was observed that during UV irradiation of polyethylene films the monomer fluorescence of the complex (λ max=450 nm) transforms into excimer fluorescence (λ max=535 nm…
Luminescence and Fluorescent MaterialsPhotochromic and Fluorescence ChemistryPhotopolymerization techniques and applications
Michael F. Ashby、Y. Bréchet、David Cebon2002-06-05Advanced Engineering Materials
Designers employ a number of strategies in choosing material and processes. The choice can be based on engineering analysis, identifying candidates that best meet the mechanical, thermal, electrical and economic constraints of the design. It can be based on past experience, accessed through a questionnaire-based selec…
Design Education and PracticeMaterial Selection and PropertiesChemistry Education and Research
L. Paul Chew、Klara Kedem2002-06-05OpenAlex
We define and prove properties of the consensus shape for a family of proteins, a protein-like structure that provides a compact summary of the significant structural information for a protein family. If all members of a protein family exhibit a geometric relationship between corresponding alpha carbons then that rela…
Protein Structure and DynamicsMicrobial Natural Products and BiosynthesisEnzyme Structure and Function
A. K. Heilman、Y. Y. Xue、B. Lorenz 等 8 位作者2002-06-05Physical review. B, Condensed matter
Magnetization, resistivity, thermal expansion, thermopower, and neutron powder diffraction data are presented for the perovskite manganite ${\mathrm{Pr}}_{0.7}{\mathrm{Ba}}_{0.3}{\mathrm{MnO}}_{3}.$ A distinct ferromagnetic insulating state, similar to that observed in the ${\mathrm{La}}_{0.88}{\mathrm{Sr}}_{0.12}{\ma…
Magnetic and transport properties of perovskites and related materialsRare-earth and actinide compoundsAdvanced Condensed Matter Physics
Serena C. Tarantino、Tiziana Boffa Ballaran、Michael A. Carpenter 等 5 位作者2002-06-05European Journal of Mineralogy
Infrared spectra of natural, synthetic and heat treated orthopyroxene samples belonging to the enstatite-ferrosilite join were investigated in the range 70–1400 cm −1 . Correlations of the wavenumber shifts and line broadening systematics with the thermodynamic mixing properties were found. Wavenumber shifts of the hi…
High-pressure geophysics and materialsGlass properties and applicationsCrystal Structures and Properties
Alexandra Perschke、Thomas Fuhrmann‐Lieker2002-06-05Advanced Materials
Multifunctional molecular glasses are versatile tools for organic optoelectronics. Their optical waveguide properties are of increasing interest. By using photopatterned molecular azo glass gratings, optical waves within multilayer devices can be controlled, optically excited, and brought to resonance.
Organic Light-Emitting Diodes ResearchNonlinear Optical Materials ResearchSynthesis and properties of polymers
Torsten Reuter、Olivia Vidoni、Viktória Torma 等 8 位作者2002-06-05Nano Letters
A new approach to one-dimensionally organize the quantum dot Au 55 (PPh 3 ) 12 Cl 6 is described by using poly(vinyl-pyrrolidone) (PVP) molecules as templates. AFM investigations indicate chemisorption of the nanoclusters at the surface of the polymers. Using Langmuir−Blodgett techniques, networks of cluster-loaded po…
Gold and Silver Nanoparticles Synthesis and ApplicationsQuantum Dots Synthesis And PropertiesNanocluster Synthesis and Applications
N. Sooraj Hussain、Y Prabhakara Reddy、S. Buddhudu2002-06-05Spectroscopy Letters
This short paper summarizes the preparation and optical characterization of the Eu3+ (X=0.2,0.5,1.0,1.5 & 2.0 mol%) doped 60ZnO+20B2O3+(20-X) SiO2 glasses from the measurement of their excitation and luminescence spectra at the room temperature. Dependence of red emission performance upon the excitation wavelengths in…
Luminescence Properties of Advanced MaterialsGlass properties and applicationsPhase-change materials and chalcogenides
Oliver Franke、Beatrix E. Wiesler、Nicolai Lehnert 等 7 位作者2002-06-05Inorganic Chemistry
The bonding of N(2) to the five-coordinate complexes [FeX(depe)(2)](+), X = Cl (1a) and Br (1b), has been investigated with the help of X-ray crystallography, spectroscopy, and quantum-chemical calculations. Complexes 1a and 1b are found to have an XP(4) coordination that is intermediate between square-pyramidal and t…
Magnetism in coordination complexesMetal-Catalyzed Oxygenation MechanismsAmmonia Synthesis and Nitrogen Reduction
Paolo Orlandi、A. Meerschaut、P. Palvadeau 等 4 位作者2002-06-05European Journal of Mineralogy
Moeloite is a new lead-antimony sulfosalt, Pb 6 Sb 6 S 14 (S 3 ), discovered in the Ceragiola marble quarry, near Seravezza town (Tuscany, Italy). Associated minerals are: sulphur, pyrite and enargite. It crystallizes as very thin needles and soft plumose aggregates of flexible thin fibres with a metallic lustre. Unde…
Glass properties and applicationsCrystal Structures and PropertiesSolid-state spectroscopy and crystallography
Meenal Kowshik、Neelima Deshmukh、W. Vogel 等 6 位作者2002-06-05Biotechnology and Bioengineering
Cadmium sulfide nanoparticles were synthesized intracellularly by a Schizosaccharomyces pombe strain when challenged with 1 mM cadmium in solution. The nanoparticles, a known semiconducting material, exhibited an absorbance maximum at 305 nm. X-ray scattering data showed that the nanoparticles had a Wurtzite (Cd16S20)…
Quantum Dots Synthesis And PropertiesChalcogenide Semiconductor Thin FilmsAdvanced Nanomaterials in Catalysis
Miao Du、Ya‐Mei Guo、Xian‐He Bu 等 5 位作者2002-06-05New Journal of Chemistry
Two new diazamesocyclic ligands based on 1,4-diazacycloheptane (DACH), functionalized by additional heterocyclic donor groups, 1,4-bis(pyridin-2-ylmethyl)-1,4-diazacycloheptane (L1) and 1,4-bis(imidazol-4-ylmethyl)-1,4-diazacycloheptane (L2), together with their CuII complexes [Cu2(μ-Cl)(L1)2](ClO4)3 (1) and [Cu2(μ-Cl…
Metal complexes synthesis and propertiesMagnetism in coordination complexesMetal-Catalyzed Oxygenation Mechanisms
Thomas B. Schrøder、Jeppe C. Dyre2002-06-05Physical Chemistry Chemical Physics
A brief review of experimental facts regarding ac electronic and ionic conduction in disordered solids is given followed by a discussion of what is perhaps the simplest realistic model, the random barrier model (symmetric hopping model). Results from large scale computer simulations are presented, focusing on universa…
Glass properties and applicationsSolid-state spectroscopy and crystallographyChemical and Physical Properties of Materials
Feng Shi、Biao Dong、D. Qiu 等 6 位作者2002-06-05Advanced Materials
Robust multilayer patterns have been created via layer-by-layer self-assembly using a photochemical linking process that involves aromatic azo group cleavage and coupling with carbonyl oxygens from an adjacent polymer strand. The patterning is based on the solubility difference of the photoreactive multilayer before a…
Polymer Surface Interaction StudiesAdhesion, Friction, and Surface InteractionsNanofabrication and Lithography Techniques