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Gradient-Corrected Density Functional Calculation of Elastic Constants of Fe, Co and Ni in bcc, fcc and hcp Structures

G. Y. Guo、H. H. Wang2000-10-01Chinese Journal of Physics

Systematic ab initio calculations of lattice constants, elastic constants and magnetic moments of Fe, Co and Ni in bcc, fcc and hcp structures have been carried out, in part to understand the phase stability and magnetic properties of artificial Fe, Co and Ni structures. The calculations are based on the local spin-de…

Microstructure and mechanical propertiesMetal and Thin Film MechanicsHeusler alloys: electronic and magnetic properties

Degradation of insulating materials under electrical stress

C. Mayoux2000-10-01IEEE Transactions on Dielectrics and Electrical Insulation

An avalanche of physical and physicochemical phenomena, often self-sustained, leads to the end of life of an insulating material. The collapse of the insulating role of a material is mostly due to the electrical field stress. The path leading from the catastrophic situation, the breakdown, back to its origin is follow…

High voltage insulation and dielectric phenomenaPower Transformer Diagnostics and InsulationElectrostatic Discharge in Electronics

A Novel Peanut-like Nanostructure of II-VI Semiconductor CdS and ZnS

Yijin Xie、Jiale Huang、Bin Li 等 5 位作者2000-10-01Advanced Materials

Metal sulfide cores self-encapsulated in shells of the same material are formed via the in-situ source–template interface reaction route described by these authors. In this method, reaction occurs at the static organic/aqueous interface to produce peanut-shaped nanostructures of either CdS or ZnS (see Figure). A mecha…

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

Purification and Characterization of glpX -Encoded Fructose 1,6-Bisphosphatase, a New Enzyme of the Glycerol 3-Phosphate Regulon of Escherichia coli

Janet L. Donahue、Jennifer L. Bownas、Walter G. Niehaus 等 4 位作者2000-10-01Journal of Bacteriology

In Escherichia coli, gene products of the glp regulon mediate utilization of glycerol and sn-glycerol 3-phosphate. The glpFKX operon encodes glycerol diffusion facilitator, glycerol kinase, and as shown here, a fructose 1,6-bisphosphatase that is distinct from the previously described fbp-encoded enzyme. The purified…

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

The First Structurally Alternating Copper(II) Chain with Alternate Single End-on and End-to-End Azido Bridging: A Synthesis, Crystal Structure, and Low-Temperature Magnetic Study

Partha Sarathi Mukherjee、Tapas Kumar Maji、Golam Mostafa 等 5 位作者2000-10-01Inorganic Chemistry

A novel 1-D chain of Cu(II) with alternate single end-on and single end-to-end azido bridge having a very high Cu−N3(1,1)−Cu bond angle (129.98°) has been synthesized and characterized, which shows an intrachain antiferromagnetic interaction (J = −11.5 cm-1 for end-on bridge and −2.7 cm-1 for end-to-end bridge).

Magnetism in coordination complexesMolecular Junctions and NanostructuresOrganic and Molecular Conductors Research

Spin states of Mn and Co inLaMn0.5Co0.5O3

P. A. Joy、Yogesh B. Khollam、S. K. Date2000-10-01Physical review. B, Condensed matter

High-temperature susceptibility measurements have indicated that the spin states of Mn and Co are different in the two different phases of the ferromagnetic oxide ${\mathrm{LaMn}}_{0.5}{\mathrm{Co}}_{0.5}{\mathrm{O}}_{3}.$ Mn and Co ions are present in their trivalent state as high-spin ${\mathrm{Mn}}^{3+}$ and low-sp…

Magnetic and transport properties of perovskites and related materialsRare-earth and actinide compoundsAdvanced Condensed Matter Physics

Synchrotron x-ray-diffraction study of orbital ordering inYVO3

M. Noguchi、Atsushi Nakazawa、Sachiko Oka 等 7 位作者2000-10-01Physical review. B, Condensed matter

Synchrotron x-ray-diffraction experiments have been carried out in a perovskite-type vanadium oxide ${\mathrm{YVO}}_{3}$ to elucidate orbital ordering of the system. The change from C- to G-type orbital ordering at the lower magnetic transition temperature was strongly suggested. The long-range orbital ordering appear…

Magnetic and transport properties of perovskites and related materialsMultiferroics and related materialsAdvanced Condensed Matter Physics

Dissolution and Deagglomeration of Silicon Nitride in Aqueous Medium

Eric Laarz、Boris Zhmud、Lennart Bergström2000-10-01Journal of the American Ceramic Society

Silicon nitride undergoes hydrolysis and dissolution when subjected to an aqueous environment. Molecular dynamics simulations suggest that hydrolysis proceeds through nucleophilic attack of water with the formation of an intermediate molecular complex involving a pentacoordinated silicon. We found that the dissolution…

Advanced ceramic materials synthesisSemiconductor materials and devicesElectronic and Structural Properties of Oxides

Correlation Between Physicochemical Characteristics and Binding Capacities of Chitosan Products

H.K. No、K.S. Lee、Samuel P. Meyers2000-10-01Journal of Food Science

ABSTRACT: Physicochemical characteristics (molecular weight, nitrogen, ash, degree of deacetylation, bulk density, viscosity, and residual amino acids) of 6 commercial chitosans differed with products. Significant correlations were observed between molecular weight and viscosity and between nitrogen and degree of deac…

Proteins in Food SystemsNanocomposite Films for Food PackagingBiochemical Analysis and Sensing Techniques

Self-Assembled Ceramics Produced by Complex-Fluid Templation

Daniel M. Dabbs、İlhan A. Aksay2000-10-01Annual Review of Physical Chemistry

This review examines the use of self-assembly in the fabrication of ceramic mesostructures, emphasizing the use of amphiphilic surfactants and block copolymers. The association between this area of research and biomimetics is discussed, linking developments in synthetic self-assembly with biomineralization. The fabric…

Mesoporous Materials and CatalysisCalcium Carbonate Crystallization and InhibitionDiatoms and Algae Research

Spin-glass dynamics ofLa0.95Sr0.05CoO3

D. N. H. Nam、R. Mathieu、П. Нордблад 等 5 位作者2000-10-01Physical review. B, Condensed matter

Experimental studies of dynamic magnetic properties of a highly homogeneous sample of ${\mathrm{La}}_{0.95}{\mathrm{Sr}}_{0.05}{\mathrm{CoO}}_{3}$ perovskite evidence the existence of a low-temperature spin-glass phase. A dynamic scaling analysis of ac susceptibility data according to conventional critical slowing dow…

Theoretical and Computational PhysicsMagnetic and transport properties of perovskites and related materialsAdvanced Condensed Matter Physics

Magnesium coordination environments in glasses and minerals: New insight from high-field magnesium-25 MAS NMR

Scott Kroeker、Jonathan F. Stebbins2000-10-01American Mineralogist

A comparison of 25 Mg magic angle spinning (MAS) NMR spectra of crystalline and glassy diopside (CaMgSi 2 O 6 ) reveals that the chemical shift in the disordered phase corresponds to that of the mineral, suggesting that sixfold coordination is essentially retained upon vitrification. Likewise, a crystalline leucite an…

Glass properties and applicationsAdvanced NMR Techniques and ApplicationsNMR spectroscopy and applications

Thermomechanical Behavior of High‐Alumina Refractory Castables with Synthetic Spinel Additions

Fabien Simonin、C. Olagnon、Sandrine Maximilien 等 6 位作者2000-10-01Journal of the American Ceramic Society

The thermomechanical behavior of a high‐alumina refractory that contains 10 wt% of synthetic spinel has been studied. Results have been correlated with the microstructural and mineralogical evolutions using X‐ray diffraction and scanning electron microscopy, as function of the firing temperature. Dry, castable, raw‐ma…

Advanced ceramic materials synthesisHigh-Velocity Impact and Material BehaviorNuclear materials and radiation effects

A novel free-mounting system for protein crystals: transformation and improvement of diffraction power by accurately controlled humidity changes

R. Kiefersauer、Manuel E. Than、Holger Dobbek 等 9 位作者2000-10-01Journal of Applied Crystallography

A novel device for capillary-free mounting of protein crystals is described. A controlled stream of air allows an accurate adjustment of the humidity at the crystal. The crystal is held on the tip of a micropipette. With a video system (CCD camera), the two-dimensional shadow projections of crystals can be recorded fo…

Protein Structure and DynamicsEnzyme Structure and FunctionCrystallization and Solubility Studies

Fast Response Photochromic Mesostructures

Gernot Wirnsberger、Brian J. Scott、B. F. Chmelka 等 4 位作者2000-10-01Advanced Materials

Direct photochromism is observed for the mesostructured host–photochromic guest system reported here. Block-copolymer/silica mesostructures were used as hosts for two photochromic dyes, a spirooxazine and a spiropyran. It is shown that the dyes are incorporated predominantly within the hydrophobic occlusions of the me…

Porphyrin and Phthalocyanine ChemistryPhotochromic and Fluorescence Chemistry

Predicting Bursting Strength of Cotton Plain Knitted Fabrics Using Intelligent Techniques

Şeniz Ertuğrul、Nuray Uçar2000-10-01Textile Research Journal

The bursting strength of cotton plain knitted fabrics is predicted before manufacturing using intelligent techniques of neural network and neuro-fuzzy approaches in this re search. Among many parameters that affect fabric bursting strength, fabric weight, yarn breaking strength, and yarn breaking elongation are input…

Textile materials and evaluationsIndustrial Vision Systems and Defect Detection

Study of Precipitation Reactions by X-ray Microscopy: CaCO3 Precipitation and the Effect of Polycarboxylates

Jens Rieger、Juergen Thieme、Claudia Schmidt2000-10-01Langmuir

A fundamental understanding of precipitation reactions is based on information about the structural evolution of the system on all length scales and starting at the beginning of the reaction. We introduce X-ray microscopy as an additional analytical tool in order to achieve this understanding. X-ray microscopy combine…

Calcium Carbonate Crystallization and InhibitionCO2 Sequestration and Geologic InteractionsMinerals Flotation and Separation Techniques

Mechanism of the Olefin Epoxidation Catalyzed by Molybdenum Diperoxo Complexes: Quantum-Chemical Calculations Give an Answer to a Long-Standing Question

Dirk V. Deubel、Jörg Sundermeyer、Gernot Frenking2000-10-01Journal of the American Chemical Society

Quantum-chemical calculations at the B3LYP level have been carried out to elucidate the reaction mechanism of the epoxidation of ethylene with the molybdenum diperoxo complex MoO(O 2 ) 2 OPH 3 . All relevant transition states and intermediates which belong to the reaction pathways suggested by Mimoun and by Sharpless…

Organometallic Complex Synthesis and CatalysisPolyoxometalates: Synthesis and ApplicationsMetal-Catalyzed Oxygenation Mechanisms

Comparative Study of the Photophysical Properties of Nonplanar Tetraphenylporphyrin and Octaethylporphyrin Diacids

Vladimir S. Chirvony、Arie van Hoek、Victor A. Galievsky 等 6 位作者2000-10-01The Journal of Physical Chemistry B

The photophysical properties of the lowest excited singlet states, S 1 (π,π*), of two porphyrin diacids have been investigated. The diacids are H 4 TPP 2+ and H 4 OEP 2+, the diprotonated forms of free base tetraphenylporphyrin (H 2 TPP) and octaethylporphyrin (H 2 OEP), respectively. Both diacids exhibit perturbed st…

Porphyrin and Phthalocyanine ChemistryPhotodynamic Therapy Research StudiesPhotochemistry and Electron Transfer Studies

An Approach to Core−Shell-Type Architectures in Hyperbranched Polyglycerols by Selective Chemical Differentiation

Rainer Haag、Jean‐François Stumbé、Alexander Sunder 等 5 位作者2000-10-01Macromolecules

In contrast to dendrimers, hyperbranched polymers show no distinguishable interior and periphery. Hyperbranched polyglycerol, however, possesses two types of OH functionalities (arising from linear and terminal glycerol units), which can be chemically differentiated. To generate a core−shell-type architecture in hyper…

RNA Interference and Gene DeliveryChemical Synthesis and AnalysisDendrimers and Hyperbranched Polymers