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A fourfold coordinated point defect in silicon

Stefan Goedecker、Luc Billard、Thierry Deutsch2002-01-11arXiv

Due to their technological importance, point defects in silicon are among the best studied physical systems. The experimental examination of point defects buried in bulk is difficult and evidence for the various defects usually indirect. Simulations of defects in silicon have been performed at various levels of sophis…

Materials Science

Hole concentration in a diluted ferromagnetic semiconductor

Raimundo R. dos Santos、Luiz E. Oliveira、J. d'Albuquerque e Castro2002-01-11arXiv

We consider a mean-field approach to the hole-mediated ferromagnetism in III-V Mn-based semiconductor compounds to discuss the dependence of the hole density on that of Mn sites in Ga_{1-x}Mn_xAs. The hole concentration, p, as a function of the fraction of Mn sites, x, is parametrized in terms of the product m*J_{pd}^…

Strongly Correlated ElectronsMaterials Science

Saturation of electrical resistivity in metals at large temperatures

M. Calandra、O. Gunnarsson2002-01-11arXiv

We present a microscopic model for systems showing resistivity saturation. An essentially exact quantum Monte-Carlo calculation demonstrates that the model describes saturation. We give a simple explanation for saturation, using charge conservation and considering the limit where thermally excited phonons have destroy…

Strongly Correlated ElectronsMaterials Science

Edge states and determination of pairing symmetry in superconducting Sr2RuO4

K. Sengupta、Hyok-Jon Kwon、Victor M. Yakovenko2002-01-11arXiv

We calculate the energy dispersion of the surface Andreev states and their contribution to tunneling conductance for the order parameters with horizontal and vertical lines of nodes proposed for superconducting Sr2RuO4. For vertical lines, we find double peaks in tunneling spectra reflecting the van Hove singularities…

Materials ScienceSuperconductivity

The nonlinear viscoelastic behavior of polypropylene

A. D. Drozdov、J. deC. Christiansen2002-01-11arXiv

A series of tensile relaxation tests is performed on isotactic polypropylene in the sub-yield and post-yield regions at room temperature. Constitutive equations are derived for the time-dependent response of a semicrystalline polymer at isothermal loading with small strains. Adjustable parameters in the stress-strain…

Materials Science

More on``Atomic motions in the crystalline Al$_{50}$Cu$_{35}$Ni$_{15}$ alloy''

Gerrit Coddens2002-01-11arXiv

We refute recent claims that ultrafast atomic jumps as observed in quasicrystals (QC) could be called phasons in many crystalline alloys by pointing out that there is a genuine conceptual difference between the hopping dynamics in an imperfect crystal containing a substantial number of vacancies, and the hopping dynam…

Materials Science

Lane formation in colloidal mixtures driven by an external field

Joachim Dzubiella、G. P. Hoffmann、Hartmut Löwen2002-01-11Physical review. E, Statistical physics, plasmas, fluids, and related interdisciplinary topics

The influence of an external field on a binary colloidal mixture performing Brownian dynamics in a solvent is investigated by nonequilibrium computer simulations and simple theory. In our model, one half of the particles are pushed into the field direction while the other half of them are pulled into the opposite dire…

Material Dynamics and PropertiesNonlinear Dynamics and Pattern FormationAdvanced Thermodynamics and Statistical Mechanics

Exchange Splitting and Charge Carrier Spin Polarization in EuO

Peter G. Steeneken、L. H. Tjeng、Ilya Elfimov 等 7 位作者2002-01-11Physical Review Letters

High quality thin films of the ferromagnetic semiconductor EuO have been prepared and were studied using a new form of spin-resolved spectroscopy. We observed large changes in the electronic structure across the Curie and metal-insulator transition temperature. We found that these are caused by the exchange splitting…

Advanced Condensed Matter PhysicsRare-earth and actinide compoundsMagnetic and transport properties of perovskites and related materials

Protein Adsorption on Model Surfaces with Controlled Nanotopography and Chemistry

Frédéric A. Denis、Per Hanarp、Duncan S. Sutherland 等 7 位作者2002-01-11OpenAlex

To evaluate the influence of substratum surface characteristics on protein adsorption processes, we have investigated the adsorption (adsorbed amount, supramolecular organization) of collagen on model substrata exhibiting controlled topography and surface chemistry. Substrata were prepared in two steps: (i) gold depos…

Marine Biology and Environmental ChemistryPolymer Surface Interaction StudiesCollagen: Extraction and Characterization

Synthesis and Characterization of Mesostructured Titania-Based Materials through Evaporation-Induced Self-Assembly

Galo J. A. A. Soler‐Illia、Alexandra Louis、Clément Sánchez2002-01-11OpenAlex

Mesostructured TiO 2 −hexadecyltrimethylammonium bromide hybrid powders, displaying a bidimensional hexagonal pattern (p6m), have been synthesized by an evaporation-induced self-assembly (EISA) method, in ethanol/HCl/H 2 O media. Thermal treatment of these “titaniatropic” hybrid phases leads to phosphorus-free, high s…

Polyoxometalates: Synthesis and ApplicationsMesoporous Materials and CatalysisCatalytic Processes in Materials Science

β-MODIFICATION OF ISOTACTIC POLYPROPYLENE: PREPARATION, STRUCTURE, PROCESSING, PROPERTIES, AND APPLICATION

J. Varga2002-01-11OpenAlex

The methods of preparation and formation of supermolecular structures in quiescent and sheared melts and the properties of the β-modification of isotactic polypropylene (β-iPP) are reviewed. The introduction of selective β-nucleants is the most reliable method for preparation of samples rich in β-modification or of pu…

Polymer crystallization and propertiesPolymer Nanocomposites and Propertiesbiodegradable polymer synthesis and properties

Optical characterization of multilayer stacks used as phase-change media of optical disk data storage

Rongguang Liang、Chubing Peng、Kenichi Nagata 等 5 位作者2002-01-10Applied Optics

We report results of measurements of the optical constants of the dielectric layer (ZnS-SiO2), reflecting layer (aluminum-chromium alloy), and phase-change layer (GeSbTe, AgInSbTe) used as the media of phase-change optical recording. The refractive index n and the absorption coefficient k of these materials vary to so…

Liquid Crystal Research AdvancementsPhase-change materials and chalcogenidesSemiconductor Lasers and Optical Devices

Approach for the calculation of high‐order connectivity indices of polymers and its application

Chongli Zhong、Chunsheng Yang2002-01-10Journal of Polymer Science Part B Polymer Physics

Abstract A method for the calculation of connectivity indices of polymers was developed that can be used to calculate any order connectivity indices of polymers in a consistent and unambiguous manner without any truncation errors. The proposed method makes it possible to correlate the physical properties of polymers i…

Polymer crystallization and propertiesCarbon Nanotubes in CompositesThermal properties of materials

SYNTHESIS OF HYDROPHILIC ULTRAFINE NANOPARTICLES COORDINATED WITH CARBOHYDRATE CLUSTER

Jun‐ichi Tamura、Masumi Fukuda、Junko Tanaka 等 4 位作者2002-01-10Journal of Carbohydrate Chemistry

A hydrophilic phosphine oxide (1) as a suitable ligand for semiconductor nanoparticles was synthesized. The hydrophilicity of the phosphine oxide was enhanced by introduction of three mannose moieties to the end of the molecule via amide linkages. The ligand 1 was able to coordinate to the CdSe/ZnS nanoparticle making…

Quantum Dots Synthesis And PropertiesAdvanced biosensing and bioanalysis techniquesNanocluster Synthesis and Applications

Photoionization of Tetraphenylporphyrin in Mesoporous SiMCM-48, AlMCM-48, and TiMCM-48 Molecular Sieves

Zhixiang Chang、Larry Kevan2002-01-10Langmuir

Electron spin resonance spectroscopy has been used to detect the photoionization yield of meso -tetraphenylporphyrin (H 2 TPP) in SiMCM-48, AlMCM-48, and TiMCM-48 mesoporous molecular sieves. MCM-48 materials are shown to be effective heterogeneous hosts to accomplish long-lived photoinduced electron transfer of bulky…

Metal-Organic Frameworks: Synthesis and ApplicationsMesoporous Materials and CatalysisPorphyrin and Phthalocyanine Chemistry

Temporal and Spatial Distribution of Diatoms in the Surface Sediments of the Venice Lagoon

Chiara Facca、Adriano Sfriso、Giorgio Socal2002-01-10Botanica Marina

The aim of this paper was to improve the knowledge of the primary producers living in the Venice Lagoon by studying the composition and the distribution of the benthic diatom communities populating subtidal surface sediments. The upper 5mm of sediment from four areas distributed between the Malamocco inlet and the mai…

Marine Biology and Ecology ResearchDiatoms and Algae ResearchMarine and coastal ecosystems

The role played by two parallel free surfaces in the deformation mechanism of nanocrystalline metals: a molecular dynamics simulation

H. Van Swygenhoven、P. M. Derlet2002-01-10Philosophical magazine. A/Philosophical magazine. A. Physics of condensed matter. Structure, defects and mechanical properties

Abstract We report molecular dynamics simulations which investigate the influence of two parallel free surfaces in the deformation mechanisms of model nanocrystalline fee materials. The purpose of this simulation is to study which phenomena observed in in-situ tensile experiments performed in the electron microscope c…

Ion-surface interactions and analysisMicrostructure and mechanical propertiesMetal and Thin Film Mechanics

New Organic Superconductors Consisting of an Unprecedented π-Electron Donor

Hiroyuki Nishikawa、T. Morimoto、Takeshi Kodama 等 8 位作者2002-01-10Journal of the American Chemical Society

The synthesis and electrochemical properties of a new organic donor, (1,4-dioxan-2,3-diyldithio)dihydrotetrathiafulvalene (DODHT), and the crystal structures and physical properties of its superconducting salts are described. The DODHT molecule has the bulky dioxane ring condensed by cis fusion, and the reduced pi-ele…

N-Heterocyclic Carbenes in Organic and Inorganic ChemistryOrganic and Molecular Conductors ResearchMagnetism in coordination complexes

Ru3(CO)12 Adsorption and Decomposition on TiO2

Douglas C. Meier、Gian Andrea Rizzi、Gaetano Granozzi 等 5 位作者2002-01-10Langmuir

Triruthenium dodecacarbonyl (Ru 3 (CO) 12 ) adsorption and decomposition on titania (TiO 2 ) were studied using infrared reflection absorption spectroscopy, temperature-programmed desorption, Auger electron spectroscopy, and scanning tunneling microscopy. It was found that the vapor-deposited cluster adsorbs with the…

Catalysis and Oxidation ReactionsCatalytic Processes in Materials ScienceAdvanced Chemical Physics Studies

SOLUBILITY OF CALCIUM LACTATE IN AQUEOUS SOLUTION

N. Kubantseva、Richard W. Hartel2002-01-10Food Reviews International

The presence of calcium lactate (CaL2) crystals on the surface of Cheddar cheese is an appearance defect that consumer often attributes to mold. This problem is widespread in the cheese industry. The solubility of CaL2in water determines the likelihood of formation of CaL2crystals on the surface of Cheddar cheese. Ver…

Crystallization and Solubility StudiesProbiotics and Fermented FoodsMeat and Animal Product Quality