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Ab initio and MNDO Calculations of the 35Cl NQR Parameters of Some Organic and Inorganic Molecules

В. П. Фешин、M. Yu. Kon'shin1996-06-01Zeitschrift für Naturforschung A

Abstract The results of ab initio and MNDO calculations of the Cl 2 C = CHOCH 3 , XCOCl (X = CH 3 , OCH 3 and COCl), 4-ClC 6 H 4 CH 2 Cl, (CNCl) 3 and PCl 5 with total optimization of their geometry are presented. The ab initio calculations were executed using Hartree-Fock theory and the split valence basis set 6-31G*…

Advanced NMR Techniques and ApplicationsSolid-state spectroscopy and crystallographyElectron Spin Resonance Studies

Growth and characterization of anodic oxides on Si(100) formed in 0.1 M hydrochloric acid

J. A. Bardwell、N.D. Draper、Patrik Schmuki1996-06-01Journal of Applied Physics

Anodic oxides of thickness 1–10 nm have been grown on Si(100) using anodic oxidation at room temperature. The electrolyte was 0.1 M HCl. The effects of the anodic potential, growth time, external visible illumination intensity, substrate doping type, and density on the oxide thickness were determined. Coulometric and…

Semiconductor materials and devicesSilicon Nanostructures and PhotoluminescenceAnodic Oxide Films and Nanostructures

Transition from hopping conduction to band conduction in LaFe x Ni1–x O3

Woo Hwan Jung、E. Icuchi1996-06-01Philosophical Magazine B

Electrical transport and the nature of carriers in the homovalent substitution LLaFe x Ni1–x O3 were investigated as a function of component, in the temperature range 10K–300K, by dielectric properties, dc and ac conductivities and thermopowers. At x > 0·6, the positive thermopowers indicate the major carriers of hole…

Ferroelectric and Piezoelectric MaterialsMagnetic and transport properties of perovskites and related materialsMultiferroics and related materials

Structural Degradation of Tobermorite during Vibratory Milling

Kaori Sasaki、Tsuguya Masuda、Hideki Ishida 等 4 位作者1996-06-01Journal of the American Ceramic Society

Mechanochemistry of hydrothermally prepared Al‐free and Al‐substituted 1.1 nm tobermorite was studied using 29 Si NMR, XRD, and TGA‐DTA. Tobermorite has a double‐chain structure and Al/Si substitution occurs preferentially at bridging tetrahedra. By using the vibration mill, both tobermorites were observed to decompos…

Glass properties and applicationsClay minerals and soil interactionsChemical Synthesis and Characterization

Zinc sorption–desorption by two Andepts: effect of pH and support medium

M. T. Pardo、M.E. Guadalix1996-06-01European Journal of Soil Science

Summary Laboratory experiments were carried out to evaluate the effect of pH, ionic strength and electrolyte composition on zinc sorption–desorption by two Andepts from the Canary Islands (Spain). At the natural soil pH, the soils exhibited little net negative surface charge and small Zn sorption capacities. More than…

Heavy metals in environmentClay minerals and soil interactionsIron oxide chemistry and applications

Dynamical Properties of Liquid Binary Alloys: A Memory Function Study

Ya. Chushak、Taras Bryk、Andrij Baumketner 等 5 位作者1996-06-01Physics and Chemistry of Liquids

The dynamical properties of binary liquid mixtures are investigated within a viscoelastic model using the memory function approach. Extending the viscoelastic model to the binary case we find that the dynamical properties of the liquid mixture are characterized by four propagating and two diffusive modes. We show that…

Material Dynamics and PropertiesThermodynamic properties of mixturesSpectroscopy and Quantum Chemical Studies

Origin of Cretaceous and Oligocene Kaolinites from the Iwaizumi Clay Deposit, Iwate, Northeastern Japan

Chitoshi Mizota、Fred J. Longstaffe1996-06-01Clays and Clay Minerals

Abstract Hydrogen- (δD = −106 to −97‰) and oxygen-(δ 18 O = +14.0 to +16.6‰) isotope compositions of kaolinite from late Cretaceous and Oligocene deposits at Iwaizumi, northeastern Japan, indicate that these clays formed by weathering of volcanic parent rocks, rather than during hydrothermal (>100 °C) alteration. T…

Geological and Geochemical AnalysisGroundwater and Isotope GeochemistryClay minerals and soil interactions

Bending energy of highly elastic membranes. II

Michael Hilgers、A. C. Pipkin1996-06-01Quarterly of Applied Mathematics

The strain energy per unit area for a deformed sheet of elastic material is estimated by representing the deformation as a power series in the thickness variable. The <italic>membrane</italic> energy is the lowest-order approximation obtained in this way. Strain-gradient and bending energies appear in the next order o…

Elasticity and Material ModelingNonlocal and gradient elasticity in micro/nano structuresStructural Analysis and Optimization

Preparation of Mullite Fiber

Lifu Chen、Baowei Wang、Shujie Liu 等 4 位作者1996-06-01Journal of the American Ceramic Society

Transparent mullite fibers have been prepared using aluminum carboxylates (ACs) and tetraethyl orthosilicate (TEOS) as starting materials. The ACs are derived from the catalyzed dissolution of elemental aluminum in a mixture of formic acid and acetic acid. The solubility of aluminum in the acids is influenced by the c…

Advanced ceramic materials synthesisAluminum Alloys Composites PropertiesMicrowave Dielectric Ceramics Synthesis

Micronecking in thin films of isotactic polypropylene

C. J. G. Plummer、Hans‐Henning Kausch1996-06-01Macromolecular Chemistry and Physics

Abstract Thin melt crystallized spherulitic films of isotactic polypropylene have been deformed in uniaxial tension at different temperatures and examined by transmission electron microscopy. As the temperature was increased above approximately −80°C, a transition from high aspect ratio craze‐like features to highly v…

Mechanical Behavior of CompositesPolymer crystallization and propertiesPolymer Nanocomposites and Properties

Energy handling capability of ZnO varistors

M. Bartkowiak、M.G. Comber、G. D. Mahan1996-06-01Journal of Applied Physics

Thermal and mechanical behavior of high power ZnO surge arresters under current pulses of various magnitude and duration is simulated. By solving heat transfer equations for a varistor disk with nonuniform electrical properties, we compute the time dependence of the temperature profile and the distribution of thermal…

High voltage insulation and dielectric phenomenaLightning and Electromagnetic PhenomenaElectromagnetic Launch and Propulsion Technology

Synthesis and Properties of A–B–A Block Copoly(ester-ethers) Comprising Poly(l-lactide) (A) and Poly(oxypropylene-co-oxyethylene) (B) with Different Molecular Weights

Chan Woo Lee、Yoshiharu Kimura1996-06-01Bulletin of the Chemical Society of Japan

Abstract An A–B–A triblock copoly(ester-ether) comprising poly(l-lactide) (A) and poly(oxyethylene-co-oxypropylene) (B) was prepared by copolymerization of l-lactide and a commercially available telechelic copolyether, Pluronic® (PN), with different molecular weights by the catalysis of tin(II) octanoate. The low mole…

Advanced Polymer Synthesis and Characterizationbiodegradable polymer synthesis and propertiesCarbon dioxide utilization in catalysis

CO adsorption and oxidation on oxygen precovered Cu(110) at 150 K: reactivity of two types of adsorbed atomic oxygen determined by scanning tunneling microscopy

W.W. Crew、R. J. Madix1996-06-01Surface Science

Scanning tunneling microscopy (STM) was used to investigate the reaction of carbon monoxide with atomic oxygen on Cu(110) in the steady state at 150 K. Oxygen dosed at 150 K reacts with copper atoms on the terraces to form CuO pseudomolecules 2–7 units long, in contrast to oxygen dosed at 300 K which forms long Cu…

Advanced Chemical Physics StudiesCatalytic Processes in Materials ScienceSurface Chemistry and Catalysis

Assembly of Thin and Thick Fibrils of Collagen II from Recombinant Procollagen II

Andrzej Fertala、David Holmes、Karl E. Kadler 等 5 位作者1996-06-01Journal of Biological Chemistry

Human type II procollagen was prepared in a recombinant system and cleaved to pC-collagen II by procollagen N-proteinase. The pC-collagen II was then used as a substrate to generate collagen II fibrils by cleavage with procollagen C-proteinase at 37 degrees C. Electron microscopy of the fibrils demonstrated that, at t…

Connective tissue disorders researchCollagen: Extraction and CharacterizationBone and Dental Protein Studies

Ultraviolet and electron radiation induced fragmentation of adsorbed ferrocene

D. Welipitiya、A. Green、J. P. Woods 等 7 位作者1996-06-01Journal of Applied Physics

From thermal desorption spectroscopy we find that ferrocene, Fe(C5H5)2, adsorbs and desorbs associatively on Ag(100). Photoemission results indicate that the initially adsorbed surface species closely resembles that of molecular ferrocene. The shift in photoemission binding energies relative to the gas phase is largel…

Advanced Chemical Physics StudiesMolecular Junctions and NanostructuresElectron and X-Ray Spectroscopy Techniques

Field distribution in cable terminations from a quasi-static approximation of the Maxwell equations

G. Lupò、Giovanni Miano、Vincenzo Tucci 等 4 位作者1996-06-01IEEE Transactions on Dielectrics and Electrical Insulation

A new model for the evaluation of the electric field in a cable termination realized through a nonlinear stress control tube (SCT), is presented in this paper. It is based on the electro-quasistatic approximation of the Maxwell equations: the Laplace equation describes the field in the nonconducting regions whereas a…

High voltage insulation and dielectric phenomenaLightning and Electromagnetic PhenomenaThermal Analysis in Power Transmission

Investigation of bismaleimide containing naphthalene unit. II. Thermal behavior and properties of polymer

Chun‐Shan Wang、Hann‐Jang Hwang1996-06-01Journal of Polymer Science Part A Polymer Chemistry

Crosslinking of 2,7-bis(4-maleimidophenoxy)naphthalene (BMPN) and 4,4-bismaleimi-dophenylmethane (BMPM) was investigated in the presence of 4,4-diaminodiphenylmethane (DDM) at the 2/1 molar ratio of bismaleimide/DDM. Their curing behaviors were characterized by infrared spectroscopy and differential scanning calorimet…

Polymer crystallization and propertiesEpoxy Resin Curing ProcessesSynthesis and properties of polymers

Measuring the Contact Angles of Liquid Droplets on Wool Fibers and Determining Surface Energy Components

Canh V. Le、N.G. Ly、Michael G. Stevens1996-06-01Textile Research Journal

Contact angles of various liquids on wool fibers are measured using the liquid droplet method. A computational technique greatly simplifies contact angle calculations. Sur face energy components of differently treated wool fibers are determined from the contact angle data using current theories of surface energy. Valu…

Surface Modification and SuperhydrophobicityPhotonic Crystals and ApplicationsNanomaterials and Printing Technologies

Raman Study of the Photoisomerization and Angular Reorientation of Azobenzene Molecules in a DR1-Doped Polymer Matrix

F. Lagugné Labarthet、C. Sourisseau1996-06-01Journal of Raman Spectroscopy

The trans cis photoisomerization and angular reorientation of an azobenzene derivative (DR1) in dye-doped polymer matrices [poly(methyl methacrylate)], induced by linearly polarized visible illumination (λ0=496.5 nm), were investigated by dichroism measurements in the visible region and by polarized resonance Raman ex…

Liquid Crystal Research AdvancementsPhotochromic and Fluorescence ChemistryMolecular spectroscopy and chirality

Influence of Water Absorption on Transverse Tensile Properties and Shear Fracture Toughness of Glass/Polypropylene

Peter Davies、Frëdëric Pomies、Leif A. Carlsson1996-06-01Journal of Composite Materials

Water absorption characteristics, and developments of transverse tensile modulus and strength, and mode II fracture toughness with water absorption of a unidirectional glass/polypropylene (PP) composite have been examined. Immersion times up to 5 months at 50°C were employed. Overall, very small amounts of water were…

Mechanical Behavior of CompositesPolymer crystallization and propertiesPolymer Nanocomposites and Properties