K. Doll2003-09-01arXiv
Nickel bulk, the low index surfaces and the adsorbate systems Ni(111) (root 3 x root3)-Cl, and Ni(111)(2 x 2)-K are studied with gradient corrected density functional calculations. It is demonstrated that an approach based on Gaussian type orbitals is capable of describing these systems. The preferred adsorption sites…
Materials Science
Tao Xu、James F. Stevens、Joseph A. Villa 等 8 位作者2003-09-01Advanced Functional Materials
Abstract Thin films of block copolymers have been used as templates and scaffolds for the fabrication of arrays of nanostructured materials. In general, a chemical modification of the film or the removal of one of the components by photodegradative methods is required to produce a nanoporous film that serves as a temp…
Advanced Polymer Synthesis and CharacterizationBlock Copolymer Self-AssemblyMachine Learning in Materials Science
I. L. Singer、S. David Dvorak、Kathryn J. Wahl 等 4 位作者2003-09-01Journal of Vacuum Science & Technology A Vacuum Surfaces and Films
The literature on protective tribological coatings often focuses on correlations with measurable coating properties (composition, structure, and mechanical) but ignores the mechanisms of friction and wear. In fact, long-lived coatings often survive because of third bodies that form inside the moving contact. This arti…
Lubricants and Their AdditivesDiamond and Carbon-based Materials ResearchTribology and Wear Analysis
Live Rekvig、Marieke Kranenburg、Jocelyne Vreede 等 5 位作者2003-09-01Langmuir
We have used dissipative particle dynamics (DPD) to simulate surfactant monolayers on the interface between oil and water. With a simple surfactant model, we investigate how variations in size and structure of surfactants influence their ability to reduce the interfacial tension. In particular, we studied the effect o…
Surfactants and Colloidal SystemsBlock Copolymer Self-AssemblySpectroscopy and Quantum Chemical Studies
Takayuki Okamoto、Ichirou Yamaguchi2003-09-01The Journal of Physical Chemistry B
The resonance wavelength of the surface plasmon in gold nanoparticles above a gold substrate has been measured using transmission absorption spectroscopy. Gold nanoparticles with diameters in the range of 20−100 nm are immobilized onto a thin gold film deposited onto a glass substrate by a self-assembled monolayer of…
Plasmonic and Surface Plasmon ResearchGold and Silver Nanoparticles Synthesis and ApplicationsPhotonic Crystals and Applications
Clemens J. Foerst、Peter E. Bloechl、Karlheinz Schwarz2003-09-01arXiv
Metal deposition of Zr an a Si(001) surface has been studied by state-of-the-art electronic structure calculations. The energy per Zr adatom as a function of the coverage shows, that Zr forms silicide islands even at low coverages. Adsorbed Zr is thermodynamically unstable against the formation of bulk silicide ZrSi2.…
Materials Science
N. Jun、G. -M. Zhang2003-09-01arXiv
By using pseudopotential method with local spin density functional approximation, the electronic band structures of Na$_{x}$CoO$_{2}$ are calculated for $x=0.25$, 0.5, 0.75, and $x=1$ in the presence of the structure relaxations. As increasing Na content, the hybridization between cobalt and oxygen orbitals is decreas…
SuperconductivityMaterials Science
Heike E. Daldrup‐Link、Martina Rudelius、Robert A.J. Oostendorp 等 12 位作者2003-09-01Radiology
PURPOSE: To label human hematopoietic progenitor cells with various magnetic resonance (MR) imaging contrast agents and to obtain 1.5-T MR images of them. MATERIALS AND METHODS: Hematopoietic progenitor cells, labeled with ferumoxides, ferumoxtran, magnetic polysaccharide nanoparticles-transferrin, P7228 liposomes, an…
Lanthanide and Transition Metal ComplexesNanoparticle-Based Drug DeliveryCancer Research and Treatments
Jonathan Barker、Janet M. Thornton2003-09-01Bioinformatics
MOTIVATION: Structural templates consisting of a few atoms in a specific geometric conformation provide a powerful tool for studying the relationship between protein structure and function. Current methods for template searching constrain template syntax and semantics by their design. Hence there is a need for a more…
Enzyme Structure and FunctionProtein Structure and DynamicsComputational Drug Discovery Methods
Hyukjae Lee、Robert F. Speyer2003-09-01Journal of the American Ceramic Society
B 4 C powder compacts were sintered using a graphite dilatometer in flowing He under constant heating rates. Densification started at 1800°C. The rate of densification increased rapidly in the range 1870°–2010°C, which was attributed to direct B 4 C–B 4 C contact between particles permitted via volatilization of B 2 O…
Advanced ceramic materials synthesisBoron and Carbon Nanomaterials ResearchAdvanced materials and composites
Xiaohong Wang、Xiaoming Sun、Daquan Yu 等 5 位作者2003-09-01Advanced Materials
A series of rare earth compound nanotubes , including hydroxides, oxides, oxysulfides, and hydroxyfluorides, have been synthesized using a facile hydrothermal method. Owing to their excellent hydrophilicity, the nanotubes can be easily functionalized, and should offer new opportunities in areas such as optoelectronic…
Electronic and Structural Properties of OxidesQuantum Dots Synthesis And Properties2D Materials and Applications
作者信息未提供2003-09-01OpenAlex
1. Introduction.- 2. Basics of Two-Dimensional Crystallography.- 3. Experimental Background.- 4. Surface Analysis I. Diffraction Methods.- 5. Surface Analysis II. Electron Spectroscopy Methods.- 6. Surface Analysis III. Probing Surfaces with Ions.- 7. Surface Analysis IV. Microscopy.- 8. Atomic Structure of Clean Surf…
Electron and X-Ray Spectroscopy Techniques
Richard G. Compton、John S. Foord、Frank Marken2003-09-01OpenAlex
Abstract Diamond as a high performance material occupies a special place due to its in many ways extreme properties, e.g., hardness, chemical inertness, thermal conductivity, optical properties, and electric characteristics. Work mainly over the last decade has shown that diamond also occupies a special place as an el…
Electrochemical Analysis and ApplicationsAnalytical Chemistry and SensorsDiamond and Carbon-based Materials Research
Shannon L. M. Dahl、Jennifer M.S. Koh、Vikas Prabhakar 等 4 位作者2003-09-01OpenAlex
More than 570,000 coronary artery bypass grafts are implanted each year, creating an important demand for small-diameter vascular grafts. For patients who lack adequate internal mammary artery or saphenous vein, tissue-engineered arteries may prove useful. However, the time needed to tissue engineer arteries (7 weeks…
Tissue Engineering and Regenerative MedicineElectrospun Nanofibers in Biomedical ApplicationsCardiac and Coronary Surgery Techniques
Xia Cao、Robert Vaßen、Werner Fischer 等 6 位作者2003-09-01OpenAlex
La 2 Ce 2 O 7 is proposed as a new material for thermal barrier coating that has a higher thermal expansion coefficient and a lower thermal conductivity than traditional coating materials. After long‐term annealing at 1400 °C, the crystal structure of La 2 Ce 2 O 7 was maintained (see Figure). Below 300 °C, thermal co…
Microwave Dielectric Ceramics SynthesisHigh-Temperature Coating BehaviorsThermal Expansion and Ionic Conductivity
Suprakas Sinha Ray、Masami Okamoto2003-09-01OpenAlex
Abstract The academic and industrial aspects of the preparation, characterization, mechanical and materials properties, crystallization behavior, melt rheology, and foam processing of pure polylactide (PLA) and PLA/layered silicate nanocomposites are described in this feature article. Recently, these materials have at…
Polymer composites and self-healingbiodegradable polymer synthesis and propertiesPolymer Nanocomposites and Properties
W.S. Zaengl2003-09-01OpenAlex
Most dangerous breakdowns are caused by the aging effects of HV insulation systems used within HV components, and there is still a lack of appropriate tools to diagnose such systems non-destructively and reliably in the field. This review introduces the theoretical background of dielectric spectroscopy in the time and…
Electrical and Bioimpedance TomographyPower Transformer Diagnostics and InsulationHigh voltage insulation and dielectric phenomena
Andreas Züttel2003-09-01OpenAlex
Hydrogen storage is a materials science challenge because, for all six storage methods currently being investigated, materials with either a strong interaction with hydrogen or without any reaction are needed. Besides conventional storage methods, i.e. high pressure gas cylinders and liquid hydrogen, the physisorption…
Hydrogen Storage and MaterialsSpacecraft and Cryogenic TechnologiesHybrid Renewable Energy Systems
Yuri D. Tretyakov2003-08-31Russian Chemical Reviews
The review concerns conservative and dissipative self-organisation phenomena in those physicochemical systems, whose evolution involves formation of diverse chemically complex products, including functional ceramics, supramolecular compounds, and nanocomposites as well as fractal, template and epitaxial structures. It…
Diatoms and Algae ResearchCalcium Carbonate Crystallization and InhibitionLaser-Ablation Synthesis of Nanoparticles
Zhijun Hu、Fajun Zhang、Binyang Du 等 5 位作者2003-08-30Langmuir
The self-assembly of poly(di- n -butylsilane) (PDBS) and poly(di- n -hexylsilane) (PDHS) on the surfaces of amorphous carbon and highly oriented pyrolytic graphite (HOPG) have been investigated, respectively. The morphology and structures of these self-assembled thin films were studied by using atomic force microscopy…
Surface Chemistry and CatalysisMolecular Junctions and NanostructuresConducting polymers and applications