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Detailed molecular dynamics simulation of the self-diffusion of n-alkane and cis-1,4 polyisoprene oligomer melts

Vagelis Harmandaris、Manolis Doxastakis、Vlasis G. Mavrantzas 等 4 位作者2002-01-01The Journal of Chemical Physics

Results are presented for the self-diffusion properties of monodisperse n-alkanes and cis-1,4 polyisoprene (PI) oligomer melts, as obtained through detailed atomistic molecular dynamics (MD) simulations. The simulations have been conducted in the NVT statistical ensemble on model systems thoroughly pre-equilibrated th…

Polymer crystallization and propertiesPhase Equilibria and ThermodynamicsMaterial Dynamics and Properties

Role of Third Bodies in Friction Behavior of Diamond-like Nanocomposite Coatings Studied byIn SituTribometry

T.W. Scharf、I. L. Singer2002-01-01Tribology Transactions

The friction and wear behavior of amorphous diamond-like nanocomposite (DLN) coatings (C:H:Si:0) in low speed, dry sliding contact has been investigated using a home-built in situ tribometer. Tests were performed under reciprocating sliding against sapphire and steel hemispheres in dry (∼4% RH) and moist (35 to 52% RH…

Diamond and Carbon-based Materials ResearchForce Microscopy Techniques and ApplicationsAdhesion, Friction, and Surface Interactions

Electronic ground and excited state properties of dipyrrometheneboron difluoride (BODIPY): Dimers with application to biosciences

Ilya Mikhalyov、N. M. Gretskaya、Fredrik Bergström 等 4 位作者2002-01-01Physical Chemistry Chemical Physics

Numerous derivatives of BODIPY (4,4-difluoro-4-borata-3a-azonia-4a-aza-s-indacene) are frequently used as fluorescent probes in modern protein and lipid research. Present studies of purpose-synthesised molecules show that the BODIPY chromophore can form two different ground state dimers, denoted DI and DII. In practis…

Molecular Sensors and Ion DetectionLuminescence and Fluorescent MaterialsAnalytical Chemistry and Sensors

Mass spectra of copolymers

Maurizio S. Montaudo2002-01-01Mass Spectrometry Reviews

Abstract I. Introduction 108 II. Structural Analysis 109 III. Copolymer Composition 111 A. Composition by the Direct Method 111 B. Composition by the Method Based on Statistics 111 C. Copolymer Composition by the Hard‐Ionization Method 113 IV. Copolymer Sequence 114 V. Molar Mass Determination 115 VI. MS as a Detector…

Advanced Polymer Synthesis and Characterizationbiodegradable polymer synthesis and propertiesAnalytical Chemistry and Chromatography

Chemical Diffusion and Oxygen Surface Transfer of La[sub 1−x]Sr[sub x]CoO[sub 3−δ] Studied with Electrical Conductivity Relaxation

L.M. van der Haar、M. W. den Otter、M. Morskate 等 5 位作者2002-01-01Journal of The Electrochemical Society

The chemical diffusion coefficient and oxygen-transfer coefficients of selected compositions in the series La<sub>1-x</sub>Sr<sub>x</sub>CoO<sub>3-δ</sub> were studied using the conductivity relaxation technique. Measurements were performed in the temperature range 600-850°C and oxygen partial pressure 10<sup>-4</sup>…

Advancements in Solid Oxide Fuel CellsMagnetic and transport properties of perovskites and related materialsElectronic and Structural Properties of Oxides

Diaphorobacter nitroreducens gen. nov., sp. nov., a poly(3-hydroxybutyrate)-degrading denitrifying bacterium isolated from activated sludge.

Shams Tabrez Khan、Akira Hiraishi2002-01-01The Journal of General and Applied Microbiology

Three denitrifying strains of bacteria capable of degrading poly(3-hydroxybutyrate) (PHB) and poly(3-hydroxybutyrate-co-3-hydroxyvalerate) (PHBV) were isolated from activated sludge and characterized. All of the isolates had almost identical phenotypic characteristics. They were motile gram-negative rods with single p…

Biofuel production and bioconversionWastewater Treatment and Nitrogen Removalbiodegradable polymer synthesis and properties

Mechanism of growth of ZnO single crystals from hydrothermal alkali solutions

L. N. Demianets、Д. В. Костомаров、I. P. Kuz’mina 等 4 位作者2002-01-01Crystallography Reports

The results obtained in experiments on the growth of zinc oxide, ZnO, under hydrothermal conditions are generalized. The polar growth and nonstoichiometry of ZnO crystals are analyzed in terms of crystal chemistry with due regard for the physicochemical conditions of the growth medium. The effect of the Li+ and of di-…

Crystallization and Solubility Studies

The effect of fatty acid composition on the acrylation kinetics of epoxidized triacylglycerols

John La Scala、Richard P. Wool2002-01-01Journal of the American Oil Chemists Society

Abstract Epoxidized oils, epoxidized triacylglycerols, and epoxidized fatty acid methyl esters were made by reaction with performic acid formed in situ . The extent of epoxidation was ca. 95% for all of the epoxidized samples, as determined by 1 H nuclear magnetic resonance. The epoxidized samples were reacted with an…

Polymer composites and self-healingCatalysis and Hydrodesulfurization StudiesCarbon dioxide utilization in catalysis

Electric Double-Layer Capacitance of Meso/Macroporous Activated Carbon Fibers Prepared by the Blending Method

Soshi Shiraishi、Hideyuki Kurihara、Shi Lan 等 5 位作者2002-01-01Journal of The Electrochemical Society

Electric Double-Layer Capacitance of Meso/Macroporous Activated Carbon Fibers Prepared by the Blending Method : I. Nickel-Loaded Activated Carbon Fibers in Propylene Carbonate Solution Containing LiClO4 Salt , Shiraishi, Soshi, Kurihara, Hideyuki, Shi, Lan, Nakayama, Takuya, Oya, Asao

Supercapacitor Materials and FabricationAdvanced Battery Materials and TechnologiesConducting polymers and applications

Pit Initiation at Single Sulfide Inclusions in Stainless Steel

Eric G. Webb、Richard C. Alkire2002-01-01Journal of The Electrochemical Society

Small wires of W, Ag, and Pt were placed within an electrochemical microcell above single sulfide inclusions to detect the pH, sulfide, and thiosulfate, respectively. In chloride-free electrolytes the onset of sulfide dissolution was accompanied by a decrease in pH of 0.5 units to 4.2, a value that is not low enough t…

Corrosion Behavior and InhibitionHydrogen embrittlement and corrosion behaviors in metalsConcrete Corrosion and Durability

Resonance cone formation, reflection, refraction, and focusing in a planar anisotropic metamaterial

K.G. Balmain、Andrea Lüttgen、P.C. Kremer2002-01-01IEEE Antennas and Wireless Propagation Letters

The material studied is a planar wire-grid network loaded with orthogonal capacitors and inductors. Over a ground plane and excited by a localized single-frequency source, this metamaterial exhibits conical high-field regions called "resonance cones." The cones exhibit specular reflection from boundaries and, with two…

Antenna Design and AnalysisMetamaterials and Metasurfaces ApplicationsAdvanced Antenna and Metasurface Technologies

Structural characterization of bis-[triethoxysilylpropyl]tetrasulfide and bis-[trimethoxysilylpropyl]amine silanes by Fourier-transform infrared spectroscopy and electrochemical impedance spectroscopy

Danqing Zhu、Wim J. van Ooij2002-01-01Journal of Adhesion Science and Technology

Bis-[triethoxysilylpropyl]tetrasulfide (or bis-sulfur silane) and bis-[trimethoxysilylpropyl] amine (or bis-amino silane) were deposited on 2024-T3 aluminum alloy (AA 2024-T3). The structures of the films were characterized using Fourier-transform infrared spectroscopy (FTIR) and electrochemical impedance spectroscopy…

Advanced ceramic materials synthesisCorrosion Behavior and InhibitionMetal and Thin Film Mechanics

A method to predict the Raman gain spectra of germanosilicate fibers with arbitrary index profiles

J. Bromage、Karsten Rottwitt、M. E. Lines2002-01-01IEEE Photonics Technology Letters

In this letter, we present a technique for calculating the Raman gain spectra of germanosilicate fibers from their index profiles. The gain spectra depend on radial profiles of the guided optical modes and the glass composition, in particular the distribution of Si-O-Si and Ge-O-Si bridging bonds. We have obtained spe…

Advanced Fiber Optic SensorsGlass properties and applicationsPhotonic Crystal and Fiber Optics

Modeling the Effects of Electrode Composition and Pore Structure on the Performance of Electrochemical Capacitors

Changqing Lin、Branko N. Popov、Harry J. Ploehn2002-01-01Journal of The Electrochemical Society

This work presents a mathematical model for charge/discharge of electrochemical capacitors that explicitly accounts for particle-packing effects in a composite electrochemical capacitor consisting of hydrous nanoparticles dispersed within porous activated carbon. The model is also used to investigate the effect of non…

Supercapacitor Materials and FabricationAdvanced battery technologies researchMembrane-based Ion Separation Techniques

Extremely Large Magnetic Entropy Change of MnAs<SUB><B>1</B>-x</SUB>Sb<SUB>x</SUB> near Room Temperature

H. Wada、K Taniguchi、Yuji Tanabe2002-01-01MATERIALS TRANSACTIONS

Magnetization of MnAs1−xSbx was measured as functions of temperature and magnetic field for 0≤x≤0.4. The entropy change caused by a magnetic field, ΔSmag, was estimated on the basis of the Maxwell relation. The ΔSmag for 0≤x≤0.3 in a field change of 5 T reaches 25–30 J/K kg, which exceeds that of other materials by a…

Advanced Thermoelectric Materials and DevicesMagnetic and transport properties of perovskites and related materialsRare-earth and actinide compounds

Accelerating water exchange for Gd III chelates by steric compression around the water binding site

Robert Ruloff、Éva Tóth、Rosario Scopelliti 等 6 位作者2002-01-01Chemical Communications

The water exchange process was accelerated for nine-coordinate, monohydrated macrocyclic GdIII complexes by inducing steric compression around the water binding site; the increased steric crowding was achieved by replacing an ethylene bridge of DOTA4- by a propylene bridge; in addition to the optimal water exchange ra…

Metal-Organic Frameworks: Synthesis and ApplicationsRadioactive element chemistry and processingLanthanide and Transition Metal Complexes

Finite-strain thermoelasticity based on multiplicative decomposition of deformation gradient

Luka Vujošević、Vlado A. Lubarda2002-01-01Theoretical and Applied Mechanics

The constitutive formulation of the finite-strain thermoelasticity is revisited within the thermodynamic framework and the multiplicative decomposition of the deformation gradient into its elastic and thermal parts. An appealing structure of the Helmholtz free energy is proposed. The corresponding stress response and…

Numerical methods in engineeringThermoelastic and Magnetoelastic PhenomenaNonlocal and gradient elasticity in micro/nano structures

Metal Deposition onto a Porous Silicon Layer by Immersion Plating from Aqueous and Nonaqueous Solutions

Farid A. Harraz、Takashi Tsuboi、Junji Sasano 等 5 位作者2002-01-01Journal of The Electrochemical Society

Immersion plating of metals (Ag, Cu, Ni) onto a porous silicon (PS) layer from aqueous and nonaqueous solutions has been studied. The modified PS layers after the immersion plating were analyzed by X-ray diffraction and X-ray photoelectron spectroscopy. Fourier transform infrared spectroscopy and scanning electron mic…

Semiconductor materials and devicesSilicon Nanostructures and PhotoluminescenceNanowire Synthesis and Applications

Overview and status of post-combustion NO<SUB align=right>x control: SNCR, SCR and hybrid technologies

L.J. Muzio、G.C. Quartucy、J.E. Cichanowiczy2002-01-01International Journal of Environment and Pollution

Requirements for reduced NOx emissions have required that emissions reduction technologies move beyond combustion controls alone. Post combustion NOx control technologies that are being applied to coalfired utility boilers include selective non catalytic reduction (SNCR), selective catalytic reduction (SCR), and combi…

Catalytic Processes in Materials Science

High quality ZnO thin films grown by plasma enhanced chemical vapor deposition

Bingsheng Li、Yichun Liu、Zhenming Chu 等 7 位作者2002-01-01Journal of Applied Physics

High quality ZnO thin films have been grown on a Si(100) substrate by plasma enhanced chemical vapor deposition using a zinc organic source [Zn(C2H5)2] and carbon dioxide (CO2) gas mixtures at the low temperature of 180 °C. The dependence of ZnO thin film quality on the gas flow rate ratio of Zn(C2H5)2 to CO2 (GFRRZC)…

ZnO doping and propertiesCopper-based nanomaterials and applicationsGa2O3 and related materials