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Normal-coordinate structural decomposition and the vibronic spectra of porphyrins

John A. Shelnutt2001-03-01Journal of Porphyrins and Phthalocyanines

The connection is made between macrocycle deformations obtained from normal-coordinate structural decomposition (NSD) and the vibronic molecular states and spectra of porphyrins. NSD is a procedure that provides a description of the time-averaged distortion of a porphyrin in terms of normal-coordinate displacements fr…

Porphyrin and Phthalocyanine ChemistryPhotodynamic Therapy Research StudiesLuminescence and Fluorescent Materials

Crystal structure determination of a series of small organic compounds from powder data

K. Goubitz、E.J. Sonneveld、H. Schenk2001-03-01Zeitschrift für Kristallographie - Crystalline Materials

Abstract The crystal structures of 2,4-di-bromo-aniline (A; C 6 H 5 NBr 2 ), 4-iodo-anisole (B; C 7 H 7 OI), 2-iodo-benzenemethanol (C; C 7 H 7 OI), 2-amino-benzothiazole (D; C 7 H 6 N 2 S) and 2-amino, 5-bromo-pyridine (E; C 5 H 5 N 2 Br) have been determined from X-ray powder diffraction data. Grid search and Rietve…

Crystallography and molecular interactionsCrystal Structures and PropertiesX-ray Diffraction in Crystallography

Application of Electron Probe Microanalysis to the Study of Geological and Planetary Materials

J. J. McGee、Klaus Keil2001-03-01Microscopy and Microanalysis

The impact of electron probe microanalysis on the study of geological and planetary materials has been tremendous. Electron microprobes evolved into routine analytical instruments in geological research laboratories as instrument capabilities improved and applications to geologic/planetary materials expanded. The cont…

X-ray Spectroscopy and Fluorescence AnalysisElectron and X-Ray Spectroscopy TechniquesIon-surface interactions and analysis

Energetics of Substituted Pollucites Along the CsAlSi 2 O 6 –CsTiSi 2 O 6.5 Join: A High‐Temperature Calorimetric Study

Hongwu Xu、Alexandra Navrotsky、M. Lou Balmer 等 5 位作者2001-03-01Journal of the American Ceramic Society

Enthalpies of drop solution for a suite of substituted pollucites with the compositions CsTi x Al 1− x Si 2 O 6+0.5 x , 0 ≤ x ≤ 1, which are synthesized using the sol–gel method, have been measured in molten lead borate (2PbO·B 2 O 3 ) at 701°C. As Ti 4+ substitutes for Al 3+ , the enthalpies of drop solution become l…

Zeolite Catalysis and SynthesisGlass properties and applicationsCrystal Structures and Properties

Ag+dynamics in the superionic and liquid phases of Ag2Se and Ag2Te by coherent quasi-elastic neutron scattering

M Hamilton、A C Barnes、WS Howells 等 4 位作者2001-03-01Journal of Physics Condensed Matter

The atomic motion of Ag + ions in superionic and liquid Ag 2 Se and Ag 2 Te has been investigated by coherent quasi-elastic neutron scattering. The presence of a Q -dependent broadening of the quasielastic peak indicates that the Ag + ion is mobile in the superionic phase of both materials. This motion takes place wit…

High-pressure geophysics and materialsSolid-state spectroscopy and crystallographyX-ray Diffraction in Crystallography

Quantitative Determination of CaCO 3 in Cement Blends by FT-IR

M.A. Legodi、D. de Waal、J.H. Potgieter2001-03-01Applied Spectroscopy

Fourier transform infrared (FT-IR) spectra have been recorded of cement blends containing between 0 and 25% limestone, as well as for 100% limestone. Integrated intensity of the out-of-plane vibration of the carbonate ion was used in relation to the integrated intensity of a peak remaining fairly constant in the cemen…

Concrete and Cement Materials ResearchCalcium Carbonate Crystallization and InhibitionThermal and Kinetic Analysis

Synthesis of a New Phosphonated Dimethacrylate: Photocuring Kinetics in Homo- and Copolymerization, Determination of Thermal and Flame-Retardant Properties

Ulrich Quittmann、Laurence Lecamp、Wassef El Khatib 等 5 位作者2001-03-01Macromolecular Chemistry and Physics

In this work, we describe the synthesis of a new dimethacrylate phosphonate monomer by condensation of methacryloyl chloride with a phosphonate diol resulting from a radical addition of allyldiethyl phosphonate with 3-mercapto propane-1,2-diol. The photochemical polymerization of this new monomer was first studied as…

Flame retardant materials and propertiesPhotopolymerization techniques and applicationsPhosphorus compounds and reactions

Experimental in situ transformation of vermiculites to study the weathering impact of tree species on the soil

Laurent Augusto、Jacques Ranger、Marie‐Pierre Turpault 等 4 位作者2001-03-01European Journal of Soil Science

Summary Weathering of soil minerals under forest seems to depend on the species present. To study the influence of tree species we placed unweathered vermiculites in the soil and assessed the impact in terms of saturation index of earth‐alkaline cations and cation exchange capacity in 64 forest stands, dominated by di…

Soil Carbon and Nitrogen DynamicsSoil and Unsaturated FlowClay minerals and soil interactions

Thermal degradation of PVC in the presence of polystyrene

Qiang Yao、Charles A. Wilkie2001-03-01Journal of Vinyl and Additive Technology

Abstract The thermal degradation of poly(vinyl chloride) (PVC) and blends of PVC with polystyrene has been studied using thermogravimetric analysis coupled to Fourier transform infrared spectroscopy. The degradation of PVC commences at weak links by an ionic pathway, but there is evidence to suggest the presence of a…

Advanced Polymer Synthesis and CharacterizationThermal and Kinetic AnalysisPolymer Science and PVC

Surface potential measurements of electron-irradiated insulators using backscattered and secondary electron spectra from an electrostatic toroidal spectrometer adapted for scanning electron microscope applications

O. Jbara、Mohamed Belhaj、Serge Odof 等 6 位作者2001-03-01Review of Scientific Instruments

A technique for the accurate determination of the surface potential US and its evolution during irradiation, is proposed. The technique is based on detecting both backscattered (BSE) and secondary electrons (SE) in a scanning electron microscope (SEM). The (BSE+SE) spectra are measured using a compact, highly sensitiv…

Semiconductor materials and devicesAdvancements in Photolithography TechniquesElectron and X-Ray Spectroscopy Techniques

Chemical Resistance and Tensile Properties of Epoxy/Polycarbonate Blend Coated Bamboo Fibres

A. Varada Rajulu、G. Babu Rao、R. Lakshminarayana Reddy 等 4 位作者2001-03-01Journal of Reinforced Plastics and Composites

The bamboo fibres belonging to the family of Dendrocalamus strictus were coated with a blend of epoxy/polycarbonate with varying polycarbonate content. The chemical resistance of these fibres to some acids, alkalis and solvents was studied. The tensile load at break for these fibres was determined. The coated fibres s…

Mechanical Behavior of CompositesNatural Fiber Reinforced CompositesEpoxy Resin Curing Processes

Conductive materials for ESD applications: an overview

R. B. Rosner2001-03-01IEEE Transactions on Device and Materials Reliability

Polymer resins, because of their low cost, versatility, and ease of use, are the principal component in many static-control items. These items include containers and packages used to store and transport sensitive electronics. This paper seeks to explain how polymers are used for these demanding applications by providi…

Advanced Sensor and Energy Harvesting MaterialsConducting polymers and applicationsRecycling and Waste Management Techniques

Atomistic simulations of cross-slip of jogged screw dislocations in copper

Tejs Vegge、T. Rasmussen、T. Leffers 等 5 位作者2001-03-01Philosophical Magazine Letters

We have performed atomic-scale simulations of cross-slip processes of screw dislocations in copper, simulating jog-free dislocations as well as different types of jogged screw dislocations. Minimum-energy paths and corresponding transition state energies are obtained using the nudged-elastic-band path technique. We fi…

Microstructure and mechanical propertiesMetal and Thin Film MechanicsSurface and Thin Film Phenomena

Synthesis, Characterization, and Relaxivity of Two Linear Gd(DTPA)−Polymer Conjugates

Maria Gabriela G.M. Duarte、M.H. Gil、Joop A. Peters 等 7 位作者2001-03-01Bioconjugate Chemistry

Two linear polyamide conjugates of Gd(DTPA)2- were synthesized and characterized by high-resolution nuclear magnetic resonance (NMR) spectroscopy and size exclusion chromatography (SEC). DTPA was copolymerized with two different diamines, 1,6-hexanediamine and trans-1,4-cyclohexanediamine, yielding the polymers DTPA-H…

Advanced MRI Techniques and ApplicationsLanthanide and Transition Metal ComplexesAdvanced NMR Techniques and Applications

Effect of Platinum Nanocluster Size and Titania Surface Structure upon CO Surface Chemistry on Platinum-Supported TiO2 (110)

Shuang Gan、Yong Liang、Donald R. Baer 等 6 位作者2001-03-01The Journal of Physical Chemistry B

The adsorption chemistry of CO on clean and Pt-supported TiO 2 (110) was investigated. It was found that surface structure of TiO 2 plays an important role in the chemistry that takes place at the surface. On the reduced (1 x 2)-reconstructed surface, CO desorbed at 140 and 170 K, while only desorption at 140 K was ob…

Catalytic Processes in Materials ScienceCatalysis and Oxidation Reactionsnanoparticles nucleation surface interactions

Kinetic analysis on formation of poly(3-hydroxybutyrate) from acetic acid by Ralstonia eutropha under chemically defined conditions

J Wang、Jian Zhen Yu2001-03-01Journal of Industrial Microbiology & Biotechnology

Batch cultures of Ralstonia eutropha in chemically defined media with acetic acid (HAc) as the sole carbon source were conducted to investigate acetate utilization, formation of poly(3-hydroxybutyrate) (PHB) and growth of active biomass (ABM) under different carbon to nitrogen (C/N) weight ratios. The specific acetate…

Enzyme Catalysis and Immobilizationbiodegradable polymer synthesis and propertiesMicrobial Metabolic Engineering and Bioproduction

Oxidation Protection of MgO–C Refractories by Means of Al 8 B 4 C 7

Tianming Wang、Akira Yamaguchi2001-03-01Journal of the American Ceramic Society

The effect of Al 8 B 4 C 7 used as an antioxidant in MgO–C refractories and the behavior of Al 8 B 4 C 7 in CO gas were investigated in the present study. Al 8 B 4 C 7 was found to react with CO gas, to form Al 2 O 3 ( s ), B 2 O 3 ( l ), and C( s ), at temperatures >1100°C. The Al 2 O 3 reacts with MgO to form MgA…

Advanced ceramic materials synthesisAluminum Alloys Composites PropertiesMagnesium Oxide Properties and Applications

Chitosan based polyelectrolyte complexes

Carlos Péniche、Waldo Argüelles‐Monal2001-03-01Macromolecular Symposia

Polyelectrolyte complexes (PECs) are formed through the electrostatic interactions between polymers carrying opposite charges. Here are presented results of basic studies on the PECs of chitosan with other polysaccharides such as sodium alginate, carboxymethyl cellulose, polygalacturonic acid and κ-carrageenan. An ext…

Hydrogels: synthesis, properties, applicationsNanocomposite Films for Food Packaging

Pressure Model of Elastic Fabric for Producing Pressure Garments

S.F. Ng、Chi Leung Hui2001-03-01Textile Research Journal

This paper develops an objective method of drafting pressure garments to provide predetermined skin-and-garment interfacial pressures on patients. To predict interfacial pressure induced by different sizes of pressure garments on a particular curved surface of the human body, the relationship between the tensile prope…

Thermoregulation and physiological responsesTextile materials and evaluations

Study of Oxygen-Doped GeSbTe Film and Its Effect as an Interface Layer on the Recording Properties in the Blue Wavelength

Tae Hee Jeong、Hun Seo Lyul Lee、Sung Min Choi 等 5 位作者2001-03-01Japanese Journal of Applied Physics

An oxygen-doped GeSbTe interface layer improves the overwriting characteristics of the phase-change optical disk in the blue wavelength. The thermal and optical properties of oxygen-doped GeSbTe film and its crystal structure were investigated. Crystallization temperature and activation energy of the amorphous Ge–Sb–T…

Chalcogenide Semiconductor Thin FilmsPhase-change materials and chalcogenidesNonlinear Optical Materials Studies