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Tight-binding molecular-dynamics study of amorphous carbon deposits over silicon surfaces

Chu‐Chun Fu、Mariana Weissmann1999-07-15Physical review. B, Condensed matter

We report in this paper a procedure to simulate the deposit of carbon diamondlike films over the Si(001) surface. We use the method of tight-binding molecular dynamics and well-known transferable C-C and Si-Si interactions. We propose for the Si-C interaction a weighted average of the single element interactions and t…

Metal and Thin Film MechanicsSemiconductor materials and devicesDiamond and Carbon-based Materials Research

Intermolecular (pyrrole)N—H...π(pyrrole) interactions in bis(2-pyrrolyl)methylferrocene, an organometallic porphyrin precursor

John F. Gallagher、Elizabeth M. Moriarty1999-07-15Acta Crystallographica Section C Crystal Structure Communications

The title compound, C19HI8FeN2 or [Fe(CsHs)(CI4HI3-N2)], crystallizes in space group P2~/n with two molecules in the asymmetric unit. The pyrrole groups take part in intermolecular (pyrrole)N--H...Tr(pyrrole) interactions through a hydrogen-bonded ring system involving four pyrrole groups, with N..-(pyrrole centroid)…

Porphyrin and Phthalocyanine ChemistrySurface Chemistry and CatalysisFerrocene Chemistry and Applications

Measurable Structure Factor of a Multi-Species Polydisperse Percus-Yevick Fluid with Schulz Distributed Diameters

Mitsuaki Ginoza、Makoto Yasutomi1999-07-15Journal of the Physical Society of Japan

An analytical function is presented of the measurable structure factor of a multi-species polydisperse Percus-Yevick fluid consisting of spherical particles with Schulz distributed diameters. As a demonstration, polydispersity effects on some structural properties in the single species polydisperse fluid are investiga…

Phase Equilibria and ThermodynamicsMaterial Dynamics and PropertiesSurfactants and Colloidal Systems

Photobleaching and photodegradation of photoluminescence in thin films of poly(methylphenylsilane)

Yoshikazu Nakayama、Hiroyuki Inagi、Mei Zhang1999-07-15Journal of Applied Physics

The photobleaching process has been studied systematically in poly(methylphenylsilane) thin films with thickness comparable to or less than the penetration depth of incident ultraviolet light. It is found out that the photoscission of σ bonds proceeds from longer segments of Si chains to shorter segments, which has be…

Organic Light-Emitting Diodes ResearchSilicone and Siloxane ChemistryPhotopolymerization techniques and applications

Electronic structure of graphitic boron at aTaB2(0001)surface

H. Kawanowa、R. Souda、K. Yamamoto 等 5 位作者1999-07-15Physical review. B, Condensed matter

The electronic structure of the ${\mathrm{TaB}}_{2}(0001)$ surface, which is terminated by graphitic boron layer has been investigated by angle-resolved ultraviolet photoelectron spectroscopy and first-principles self-consistent-charge discrete variational-$X\ensuremath{\alpha}$ calculations. The occurrence of the cha…

Graphene research and applicationsBoron and Carbon Nanomaterials ResearchSemiconductor materials and interfaces

Synthesis and cationic ring-opening polymerization of mono- and bifunctional spiro orthoesters containing ester groups and depolymerization of the obtained polymers: An approach to chemical recycling for polyesters as a model system

Kiyoko Yoshida、Fumio Sanda、Takeshi Endo1999-07-15Journal of Polymer Science Part A Polymer Chemistry

A spiro orthoester having an ester moiety, 2-acetoxymethyl-1,4,6-trioxaspiro[4.6]undecane (4) was synthesized, and its cationic polymerization and depolymerization of the obtained polymer (5) were carried out. The monomer 4 underwent cationic polymerization with a cationic catalyst to afford the corresponding poly(cyc…

Organometallic Complex Synthesis and Catalysisbiodegradable polymer synthesis and propertiesCarbon dioxide utilization in catalysis

Annealing of ion-implanted defects in diamond by MeV ion-beam irradiation

Jyoji Nakata1999-07-15Physical review. B, Condensed matter

Defects and amorphous C layers or clusters in a type-Ib diamond formed by C- or P-ion implantation under certain doses are clearly annealed or epitaxially crystallized during thermal annealing at 750 \ifmmode^\circ\else\textdegree\fi{}C or during mega-electron-volt (MeV) ion-beam irradiation at 750 \ifmmode^\circ\else…

Diamond and Carbon-based Materials ResearchIon-surface interactions and analysisIntegrated Circuits and Semiconductor Failure Analysis

Transfer and back transfer processes in Yb3+–Er3+ codoped fluoroindate glasses

Inocencio R. Martín、V.D. Rodrı́guez、V. Lavı́n 等 4 位作者1999-07-15Journal of Applied Physics

The kinetics of forward and backward energy transfer processes in fluoroindate glasses double doped with Yb3+ and Er3+ has been studied. It was possible to excite selectively Yb3+ ions and detect emission due only to these ions or combined with the emission coming from the Er3+ ions. At low concentration of Yb3+ (0.1…

Luminescence Properties of Advanced MaterialsGlass properties and applicationsSolid State Laser Technologies

Characterization of comonomer distributions in ethylene/diene copolymers by13C-NMR, and using the segregation fractionation technique by DSC and DMTA

P. Pietik�inen、P. Starck、Jukka V. Sepp�l�1999-07-15Journal of Polymer Science Part A Polymer Chemistry

Ethylene and linear, nonconjugated dienes were copolymerized with the catalyst system Cp2ZrCl2/methylaluminoxane (MAO). The comonomer incorporation and the relationships between structure and properties were evaluated by NMR and by thermal techniques, especially the segregation fractionation technique (SFT) using DSC…

Polymer crystallization and propertiesPolymer Nanocomposites and PropertiesFiber-reinforced polymer composites

First-principles study of intrinsic defects in yttrium oxysulfide

Masayoshi Mikami、Atsushi Oshiyama1999-07-15Physical review. B, Condensed matter

Atomic and electronic structures of intrinsic point defects in yttrium oxysulfides $({\mathrm{Y}}_{2}{\mathrm{O}}_{2}\mathrm{S})$ are studied by first-principles total-energy calculations based on density-functional theory combined with normconserving pseudopotentials. Energetics of all the intrinsic point defects are…

Luminescence Properties of Advanced MaterialsNuclear Materials and PropertiesElectronic and Structural Properties of Oxides

Changes in chemical structure and optical properties of polyimide films induced by ion bombardment

Lulu Zhang、Toshiaki Yasui、Hirokazu Tahara 等 4 位作者1999-07-15Journal of Applied Physics

The effect of ion bombardment on the chemical structure and optical properties of polyimide films was investigated. Oxygen and nitrogen ion beams with energies in the range of 0.5–1.0 keV and doses between 1.7×1015 and 8.2×1016 ions/cm2 were irradiated on the films, and in situ x-ray photoelectron spectroscopy (XPS) a…

Metal and Thin Film MechanicsDiamond and Carbon-based Materials ResearchPolymer Nanocomposite Synthesis and Irradiation

Quantum-classical transition of the escape rate of a biaxial spin system in a general magnetic field

Gwang-Hee Kim1999-07-15Journal of Applied Physics

Using the method of mapping of a spin problem onto a particle one, we study phase transition between quantum and classical regimes for the escape rate of biaxial spin system in the presence of both a transverse and longitudinal field. It is found that the phase diagram separating the first- from the second-order trans…

Theoretical and Computational PhysicsMagnetism in coordination complexesSpectroscopy and Quantum Chemical Studies

Synthesis and characterization of novel poly(amide-imide)s containing hexafluoroisopropylidene linkage

Der‐Jang Liaw、Been‐Yang Liaw、Jeng‐Ming Tseng1999-07-15Journal of Polymer Science Part A Polymer Chemistry

A series of novel soluble poly(amide-imide)s were prepared from the diimide-dicarboxylic acid, 2,2-bis[N-(4-carboxyphenyl)-phthalimidyl]hexafluoropropane, with various diamines by the direct polycondensation in N-methyl-2-pyrrolidinone containing CaCl2 using triphenyl phosphite and pyridine as condensing agents. All t…

Synthetic Organic Chemistry MethodsSynthesis and properties of polymersSilicone and Siloxane Chemistry

Effective material properties in twinned ferroelectric crystals

Jiřı́ Erhart、Wenwu Cao1999-07-15Journal of Applied Physics

Without external fields, ferroelectric materials will have multidomain configuration in the ferroelectric state. Detailed analysis found that twinning may not be treated as random since the number of orientations for the domain walls are limited in a given symmetry change during a ferroelectric phase transition. In ea…

Ferroelectric and Piezoelectric MaterialsNumerical methods in engineeringUltrasonics and Acoustic Wave Propagation

Effects of molecular weight of nitrocellulose on structure and properties of polyurethane/nitrocellulose IPNs

Lina Zhang、Qi Zhou1999-07-15Journal of Polymer Science Part B Polymer Physics

Semi-interpenetrating polymer network (semi-IPN) coatings were prepared by using castor oil-based polyurethane (PU) and nitrocellulose (NC) with various viscosity-average molecular weights (Mη) from 6 × 104 to 42 × 104, and coated on a regenerated cellulose (RC) film to obtain water-resistant film. The PU/NC coatings…

Advanced Cellulose Research StudiesElectrospun Nanofibers in Biomedical ApplicationsLignin and Wood Chemistry

Poly(methyl acrylate)/poly(hydroxyethyl acrylate) sequential interpenetrating polymer networks. Miscibility and water sorption behavior

José Luís Gómez Ribelles、Manuel Monleón Pradas、Gloria Gallego Ferrer 等 7 位作者1999-07-15Journal of Polymer Science Part B Polymer Physics

Sequential poly(methyl acrylate)/poly(hydroxyethyl acrylate) interpenetrating polymer networks with different poly(hydroxyethyl acrylate) contents were prepared by free radical polymerization of hydroxyethyl acrylate inside the previously polymerized poly(methyl acrylate) network. Differential scanning calorimetry on…

Advanced Sensor and Energy Harvesting MaterialsMaterial Dynamics and PropertiesPolymer Nanocomposites and Properties

Electron nanodiffraction

J. M. Cowley1999-07-15Microscopy Research and Technique

Electron nanodiffraction, particularly as performed in a dedicated STEM instrument with coherent illumination, provides, in principle, a means for obtaining information on structural detail in the range between that of STEM image resolution, about 0.2 nm, and the limits of information possible from elastic scattering…

Carbon Nanotubes in CompositesAdvanced Electron Microscopy Techniques and ApplicationsNanotechnology research and applications

Density functional study of intramolecular ferromagnetic interaction through m-phenylene coupling unit. III. Possibility of high-spin polymer

Masaki Mitani、Yu Takano、Yasunori Yoshioka 等 4 位作者1999-07-15The Journal of Chemical Physics

Because it has been well-known that the effective exchange interaction of spins is much larger within a molecule than between molecules, it is very important to design high-spin polymers linking high-spin molecules with each other as a constituent unit to obtain molecule-based ferromagnetic materials with high transit…

Organic Light-Emitting Diodes ResearchMagnetism in coordination complexesSynthesis and Properties of Aromatic Compounds

Macromolecular engineering of polylactones and polylactides. XXV. Synthesis and characterization of bioerodible amphiphilic networks and their use as controlled drug delivery systems

I Barakat、Philippe Dúbois、Ch. Grandfils 等 4 位作者1999-07-15Journal of Polymer Science Part A Polymer Chemistry

Well-defined α,ω-methacryloyl poly-ε-caprolactone (PCL) and poly(d,l)-lactide P(D,L)LA dimacromonomers have been synthesized by living ring-opening polymerization of the parent monomers initiated by diethylaluminum 2-hydroxyethylmethacrylate (Et2AlO(CH2)2OC(O)C(CH3)CH2) and terminated by reaction of the propagat…

Hydrogels: synthesis, properties, applicationsAdvanced Polymer Synthesis and Characterizationbiodegradable polymer synthesis and properties

Compatabilization of polystyrene/polypropylene blends by styrene-butadiene block copolymers with differing polystyrene block lengths

Drahom�ra Hlavat�、Zden k Hor�k、J. Hrom�dkov� 等 5 位作者1999-07-15Journal of Polymer Science Part B Polymer Physics

Compatibilization of polystyrene/polypropylene (PS/PP) blends, by use of a series of butadiene–styrene block copolymers was studied by means of small-angle X-ray scattering (SAXS) and transmission electron microscopy (TEM). The compatibilizers used differ in molar mass and the number of blocks. It was shown that the a…

Polymer crystallization and propertiesPolymer Nanocomposites and PropertiesBlock Copolymer Self-Assembly