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A theory for self-diffusion in liquids

Maxim Vergeles、Grzegorz Szamel1999-02-08The Journal of Chemical Physics

We propose an alternative approach to self-diffusion in an atomic liquid. Our starting point is an oscillatory motion of a tagged particle in its first solvation shell (cage). Only after cage relaxation is taken into account is the tagged particle able to diffuse. This approach is suitable for describing liquids where…

Material Dynamics and PropertiesThermodynamic properties of mixturesSpectroscopy and Quantum Chemical Studies

Tunneling Spectroscopy in AlNiCo Decagonal Quasicrystals

Guohong Li、Haifeng He、Wang Yun-ping 等 7 位作者1999-02-08Physical Review Letters

Tunneling spectroscopy of ${\mathrm{Al}}_{73}{\mathrm{Ni}}_{17}{\mathrm{Co}}_{10}$ decagonal single quasicrystals has been measured at ultralow temperatures. In addition to the wide pseudogap observed in previous photoemission experiments, very rich fine structures in the density of states around the Fermi energy were…

Rare-earth and actinide compoundsIntermetallics and Advanced Alloy PropertiesQuasicrystal Structures and Properties

Irreversible adsorption/deposition kinetics: A generalized approach

Zbǐgniew Adamczyk、Bernard Senger、J.‐C. Voegel 等 4 位作者1999-02-08The Journal of Chemical Physics

A generalized random sequential adsorption (RSA) approach is developed by taking into account diffusion, particle/wall hydrodynamic interactions as well as external forces (e.g., gravity). In analogy to the previous concept of Pagonabarraga and Rubı́ [Physica A 188, 553 (1992)] the position dependent available surface…

Material Dynamics and PropertiesTheoretical and Computational PhysicsPolymer Surface Interaction Studies

High density adsorbed oxygen on Rh(111) and enhanced routes to metallic oxidation using atomic oxygen

K. D. Gibson、Mark Viste、Errol Sanchez 等 4 位作者1999-02-08The Journal of Chemical Physics

Exposure of Rh(111) to atomic oxygen leads to the facile formation of a full-coverage and ordered (1×1)-O monolayer which is stable at room temperature. This result differs markedly from the half-coverage (2×1)-O overlayer which forms at saturation when using molecular oxygen. This demonstrates that kinetic rather tha…

Catalytic Processes in Materials ScienceElectron and X-Ray Spectroscopy TechniquesElectronic and Structural Properties of Oxides

Recoil growth: An efficient simulation method for multi-polymer systems

S. Consta、N. B. Wilding、D. Frenkel 等 4 位作者1999-02-08The Journal of Chemical Physics

We present a new Monte Carlo scheme for the efficient simulation of multi-polymer systems. The method permits chains to be inserted into the system using a biased growth technique. The growth proceeds via the use of a retractable feeler, which probes possible pathways ahead of the growing chain. By recoiling from trap…

Material Dynamics and PropertiesBlock Copolymer Self-AssemblyAdvanced Physical and Chemical Molecular Interactions

A phase–field paradigm for grain growth and recrystallization

Mark T. Lusk1999-02-08Proceedings of the Royal Society A Mathematical Physical and Engineering Sciences

A new model is presented for the mesoscale modelling of grain–boundary motion. Grain boundaries are treated as regions of disorder across which orientation parameters change. The framework uses a set of lattice parameters to track grain orientation, and this is done with fewer equations than the more standard approach…

Aluminum Alloy Microstructure PropertiesSolidification and crystal growth phenomenaMetallurgy and Material Forming

Identification of the Precursor State in the Initial Stages ofSi(111)−(7×7)Oxidation

K.-Y. Kim、Tae Ho Shin、Seung-Jin Han 等 4 位作者1999-02-08Physical Review Letters

The precursor state involved in the initial stages of ${\mathrm{O}}_{2}$ reaction with a $\mathrm{Si}(111)\ensuremath{-}(7\ifmmode\times\else\texttimes\fi{}7)$ surface has been a long standing problem. Using the ${\mathrm{Cs}}^{+}$ reactive scattering technique, we unambiguously show that the precursor is molecular Si…

Advanced Chemical Physics StudiesElectron and X-Ray Spectroscopy TechniquesIon-surface interactions and analysis

Spontaneous Ultraviolet Emission from233Uranium/T229horiumSamples

Robert W. Shaw、J. P. Young、Stanley P. Cooper 等 4 位作者1999-02-08Physical Review Letters

The spontaneous ultraviolet luminescence reported [G. M. Irwin and K. H. Kim, Phys. Rev. Lett. 79, 990 (1997); D. S. Richardson et al., ibid. 80, 3206 (1998)] from ${}^{233}\mathrm{uranium}$ compounds and ascribed to an ultraviolet gamma-ray emission from the metastable ${}^{229}\mathrm{thorium}$ daughter is actually…

Luminescence Properties of Advanced MaterialsRadiation Detection and Scintillator TechnologiesNuclear Physics and Applications

Formation of subsurface oxygen at Ru(0001)

Artur Böttcher、H. Niehus1999-02-08The Journal of Chemical Physics

The conditions for formation of subsurface oxygen on the Ru(0001) surface have been studied using thermal desorption spectroscopy, low energy electron diffraction (LEED) and specular helium scattering. The incorporation of oxygen has been performed via dissociative chemisorption of three molecular carriers of atomic o…

Advanced Chemical Physics StudiesCatalytic Processes in Materials ScienceCatalysis and Oxidation Reactions

Spreading of perfluoropolyalkylether films on amorphous carbon surfaces

Xiang Ma、J. Gui、Laura A. Smoliar 等 7 位作者1999-02-08The Journal of Chemical Physics

Spreading of perfluoropolyalkylether thin films on amorphous carbon surfaces has been studied by scanning microellipsometry. Two types of perfluoropolyalkylethers with the same main-chain structure and various molecular weights (between 1000 and 6000 g/mol) were used: Zdol, with OH functional end groups, and Z, with n…

Surface Modification and SuperhydrophobicityGas Dynamics and Kinetic TheoryAdhesion, Friction, and Surface Interactions

On the Reconstruction of Random Media using Monte Carlo Methods

C. Manwart、R. Hilfer1999-02-08arXiv

A simulated annealing algorithm is applied to the reconstruction of two-dimensional porous media with prescribed correlation functions. The experimental correlation function of an isotropic sample of Fontainebleau sandstone and a synthetic correlation function with damped oscillations are used in the reconstructions.…

Materials Science

New boron based nanostructured materials

Ihsan Boustani、Alexander Quandt、Eduardo Hernández 等 4 位作者1999-02-08OpenAlex

Based on a series of ab initio studies we have pointed out the remarkable structural stability of nanotubular and quasiplanar boron clusters, and postulated the existence of novel layered, tubular, and quasicrystalline boron solids built from elemental subunits. The present study illustrates and predicts qualitative s…

Rare-earth and actinide compoundsBoron and Carbon Nanomaterials ResearchMXene and MAX Phase Materials

Design and Preparation of a Novel Magnet Exhibiting Two Compensation Temperatures Based on Molecular Field Theory

Shin‐ichi Ohkoshi、YUKINORI ABE、Akira Fujishima 等 4 位作者1999-02-08OpenAlex

We show the design and preparation of a novel type of magnet exhibiting two compensation temperatures; i.e., the spontaneous magnetization changes its sign twice with changing temperature. The key to obtaining this unusual behavior is the simultaneous incorporation of one antiferromagnetic and two different ferromagne…

Magnetism in coordination complexesOrganic and Molecular Conductors ResearchAdvanced NMR Techniques and Applications

Electronic Density of States of Atomically Resolved Single-Walled Carbon Nanotubes: Van Hove Singularities and End States

Philip Kim、Teri W. Odom、Jin-Lin Huang 等 4 位作者1999-02-08OpenAlex

The electronic densities of states of atomically resolved single-walled carbon nanotubes have been investigated using scanning tunneling microscopy. Peaks in the density of states due to the one-dimensional nanotube band structure have been characterized and compared with tight-binding calculations. In addition, tunne…

Carbon Nanotubes in CompositesGraphene research and applicationsFullerene Chemistry and Applications

Durable flame-retardant finished cotton fabrics characterized by thermal degradation behaviors

Shigeko Nakanishi、Fumi Masuko、Toshimasa Hashimoto1999-02-07Journal of Applied Polymer Science

After a series of investigations on the durable flame-retardant finishes, it was thought to be important to study these durable flame-retardant finished materials from the thermal analytical standpoint. Accordingly, cotton fabric was finished with N-methylol dialkyl phosphonopropionamide (Pyrovatex C) by thermofixatio…

Polymer Nanocomposites and PropertiesFlame retardant materials and propertiesThermal and Kinetic Analysis

Hybridization of aqueous-based polyurethane with glycidyl methacrylate copolymer

Guan-Nan Chen、Kan‐Nan Chen1999-02-07Journal of Applied Polymer Science

The carboxyl group containing aqueous-based polyurethane (PU) dispersions were prepared from isophorone diisocyanate, poly(propylene glycol)-1000, and 2,2-dimethylol propanic acid via a PU prepolymer process. The amino content of this amino-terminated aqueous-based PU system was determined by a styrene oxide titration…

Polymer composites and self-healingSynthetic Organic Chemistry MethodsSilicone and Siloxane Chemistry

The influence of composition ratio on the morphology of biomedical polyurethanes

Darren J. Martin、Gordon F. Meijs、Pathiraja A. Gunatillake 等 5 位作者1999-02-07Journal of Applied Polymer Science

Two series of thermoplastic polyurethane elastomers were synthesized from 4,4′-methylenediphenyl diisocyanate (MDI), 1,4-butanediol (BDO) chain extender, and each of poly(tetramethylene oxide) (PTMO) and poly(hexamethylene oxide) (PHMO) macrodiols. The PTMO and PHMO molecular weights were kept constant at 993 and 852…

Polymer composites and self-healing

Developments of high performance vibration absorber from poly(vinyl chloride)/chlorinated polyethylene/epoxidized natural rubber blend

N. Yamada、Sadao Shoji、Hiroko Sasaki 等 7 位作者1999-02-07Journal of Applied Polymer Science

A high performance vibration absorber requires a high loss factor behavior over a wide temperature and frequency range. An investigation was carried out to prepare such materials based on poly(vinyl chloride), chlorinated polyethylene, and epoxidized natural rubber ternary blends. The loss factor and damping behavior…

Polymer Nanocomposites and PropertiesVibration Control and Rheological FluidsStructural Engineering and Vibration Analysis

Electrical and mechanical properties of conducting carbon black filled composites based on rubber and rubber blends

K. P. Sau、T. K. Chaki、Dipak Khastgir1999-02-07Journal of Applied Polymer Science

The electrical and mechanical properties of new conductive rubber composites based on ethylene–propylene–diene rubber, acrylonitrile butadiene rubber (NBR), and their 50/50 (weight ratio) blend filled with conductive black were investigated. The threshold concentrations for achieving high conductivity are explained on…

Advanced Sensor and Energy Harvesting MaterialsPolymer Nanocomposites and PropertiesConducting polymers and applications

Interfacial Tension between Coexisting Isotropic and Cholesteric Phases for Aqueous Solutions of Schizophyllan

Weiliang Chen、Takahiro Sato、Akio Teŕamoto1999-02-06Macromolecules

The interfacial tension γ between the coexisting isotropic and cholesteric phases of aqueous solutions of a rigid triple-helical polysaccharide, schizophyllan, was determined by the sessile drop method, as a function of the polymer molecular weight. The values of γ are almost inversely proportional to the molecular we…

Liquid Crystal Research AdvancementsMaterial Dynamics and PropertiesSurfactants and Colloidal Systems