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Structure and Bonding of Bulk and Surface .theta.-Alumina from Periodic Hartree-Fock Calculations

András Borosy、Bernard Silvi、M. Allavena 等 4 位作者1994-12-01The Journal of Physical Chemistry

ADVERTISEMENT RETURN TO ISSUEPREVArticleNEXTStructure and Bonding of Bulk and Surface .theta.-Alumina from Periodic Hartree-Fock CalculationsA. P. Borosy, B. Silvi, M. Allavena, and P. NortierCite this: J. Phys. Chem. 1994, 98, 50, 13189–13194Publication Date (Print):December 1, 1994Publication History Published onlin…

Intermetallics and Advanced Alloy PropertiesQuasicrystal Structures and PropertiesThermodynamic and Structural Properties of Metals and Alloys

Determination of candidate structures for Lennard‐Jones‐crystals through cell optimisation

J. Christian Schön、Martin Jansen1994-12-01Berichte der Bunsengesellschaft für physikalische Chemie

Abstract We show at the example of noble gases, using the Lennard‐Jones potential to approximate the interactions between the atoms, that the global minimisation of the energy through variation of both the basis vectors of the simulation cell and the relative positions of the atoms within the cell leads to structures…

Advanced Chemical Physics StudiesCatalysis and Oxidation ReactionsMachine Learning in Materials Science

The atomic arrangement of synchysite-(Ce), CeCaF(CO 3 ) 2

Li‐Ben Wang、Yunxiang Ni、John M. Hughes 等 5 位作者1994-12-01The Canadian Mineralogist

The arrangement of atoms in synchysite-(Ce) has been solved and refined to R = 0.036 using three-dimensional X-ray-diffraction data. In contrast to the putative hexagonal cell, weak X-ray-diffraction maxima on precession films demonstrate that synchysite-(Ce) is monoclinic, C2/c, a 12.329(2), b 7.110(1), c 18.741(2) A…

Concrete and Cement Materials ResearchClay minerals and soil interactionsX-ray Diffraction in Crystallography

Synchrotron radiation x-ray absorption of ion bombardment induced defects on diamond (100)

L. J. Huang、I. Bello、W. M. Lau 等 6 位作者1994-12-01Journal of Applied Physics

The surface defect structures on diamond (100) surfaces induced by 500 eV neon ion bombardment and by subsequent annealing were studied in situ with x-ray absorption near-edge structure (XANES) spectroscopy using 250–800 eV synchrotron radiation and with low energy electron diffraction. Ex situ x-ray photoemission spe…

Semiconductor materials and devicesDiamond and Carbon-based Materials ResearchIon-surface interactions and analysis

Glass Formation and Phase Transition of Novel π-Electron Starburst Molecules, 1,3,5-Tris(phenyl-2-thienylamino)benzene and 1,3,5-Tris(phenyl-3-thienylamino)benzene

Emi Ueta、Hideyuki Nakano、Yasuhiko Shirota1994-12-01Chemistry Letters

Abstract Novel π-electron starburst molecules, 1,3,5-tris(phenyl-2-thienylamino)benzene (α-TPTAB) and 1,3,5-tris(phenyl-3-thienylamino)benzene (β-TPTAB), are found to form amorphous glasses with well-defined glass-transition temperatures of 38 and 46 °C, respectively, while 1,3,5-tris(diphenylamino)benzene instantly c…

Liquid Crystal Research AdvancementsMaterial Dynamics and PropertiesGlass properties and applications

Potassium Exchanged Layered Zirconium Phosphate as Base Catalyst in the Synthesis of 2-Nitroalkanols

Umberto Costantino、Massimo Curini、Fabio Marmottini 等 5 位作者1994-12-01Chemistry Letters

Abstract The synthesis of 2-nitroalkanols from nitroalkanes and aldehydes occurs efficiently, in mild conditions without solvent, when mediated by layered Zr(KOPO3)2. The reaction has been tested in the preparation of ten different nitroalkanols and the data obtained seem to indicate that not only the surface but also…

Layered Double Hydroxides Synthesis and ApplicationsNanomaterials for catalytic reactionsChemical Synthesis and Characterization

EVIDENCE OF CLAY ILLUVIATION IN SODIC SOILS OF THE INDO-GANGETIC PLAIN SINCE THE HOLOCENE

Deeptimayee Pal、A.R. Kalbande、S.B. Deshpande 等 4 位作者1994-12-01Soil Science

Many of the micaceous soils of the Indo-Gangetic alluvial plain of northwestern India are sodic and have clay-enriched textural B horizons. These soils sometimes lack identifiable clay skins. In order to determine the genesis of the textural B horizons of these soils, both with and without identifiable clay skins, one…

Soil and Unsaturated FlowClay minerals and soil interactionsGeochemistry and Geologic Mapping

A Novel Potentiometric Glucose Biosensor Based on Polyaniline Semiconductor Films

Elena E. Karyakina、Lylia V. Neftyakova、Arkady A. Karyakin1994-12-01Analytical Letters

Application of polyaniline semiconductor films to potentiometric biosensor development provides certain advantages comparing with the known systems. Using self-doped polyaniline instead of common polymer as pH transducer the stable potentiometric response of 70 mV/pH was obtained. Taking as an example glucose biosenso…

Electrochemical sensors and biosensorsConducting polymers and applicationsAnalytical Chemistry and Sensors

Interface formation of Bi on ceramic ZnO: A simple model varistor grain boundary

Karin Magnusson、S. Wiklund1994-12-01Journal of Applied Physics

The Schottky barrier formation between Bi and polycrystalline, ceramic ZnO has been studied with photoelectron spectroscopy (PES) under ultrahigh-vacuum conditions. This system is a simple model of a varistor compound. Evaporation of Bi on highly n-doped (Al) sintered ZnO surfaces, fractured in situ and held at room t…

ZnO doping and propertiesChalcogenide Semiconductor Thin FilmsGa2O3 and related materials

X-ray investigation of glyoxime derivatives. V. Two isomers of 2-(thienyl)glyoxime. A database study of the geometry and hydrogen bonding of the oxime group

L. F. Chertanova、Claudine Pascard、Алексей Б. Шереметев1994-12-01Acta Crystallographica Section B Structural Science

The crystal structures of two isomers of 2-(thienyl)glyoxime, 2-thienylethanedial dioxime, C 6 H 6 N 2 O 2 S, E,E [orthorhombic, Pbca, a=11.074 (5), b=9.152 (3), c=14.660 (4) A, V=1185.84 A 3 , D x =1.522 g cm -3 , Z=8, R=0.058 for 1276 reflections with I>3σ(I)] and E,Z [monoclinic, P2/c, a=12.189 (3), b=3.865 (3), c=…

HIV/AIDS drug development and treatmentCarbohydrate Chemistry and SynthesisEnzyme Structure and Function

Proton-glass behavior in a solid solution of (betaine phosphate)0.15(betaine phosphite)0.85

J. Banys、C. Klimm、G. Völkel 等 5 位作者1994-12-01Physical review. B, Condensed matter

Measurements of the dielectric permittivity are reported for a solid solution of antiferroelectric (betaine phosphate${)}_{0.15}$ and ferroelectric (betaine phosphite${)}_{0.85}$ at frequencies 20 Hz 1 MHz. The freezing phenomena in ${\mathrm{BP}}_{0.15}$${\mathrm{BPI}}_{0.85}$ reveal the characteristics of a transiti…

Material Dynamics and PropertiesGlass properties and applicationsSolid-state spectroscopy and crystallography

Metathetical Synthesis of Binary and Ternary Antiferromagnetic Gadolinium Pnictides (P, As, and Sb)

Randolph E. Treece、Jeanine A. Conklin、Richard B. Kaner1994-12-01Inorganic Chemistry

ADVERTISEMENT RETURN TO ISSUEPREVArticleNEXTMetathetical Synthesis of Binary and Ternary Antiferromagnetic Gadolinium Pnictides (P, As, and Sb)Randolph E. Treece, Jeanine A. Conklin, and Richard B. KanerCite this: Inorg. Chem. 1994, 33, 25, 5701–5707Publication Date (Print):December 1, 1994Publication History Publishe…

Rare-earth and actinide compoundsIron-based superconductors researchInorganic Chemistry and Materials

Strongly stretched polymer brushes

Scott T. Milner1994-12-01Journal of Polymer Science Part B Polymer Physics

Abstract Polymer “brushes” are formed when long‐chain molecules are somehow attached by one end at an interface with a relatively small area per chain. Such adsorbed brushes in the presence of solvent may be used to modify surface properties, stabilize colloidal particles, etc. Strongly segregated block copolymer phas…

Advanced Polymer Synthesis and CharacterizationPolymer Surface Interaction StudiesAdhesion, Friction, and Surface Interactions

Plasticizer migration from plasticized into unplasticized poly(vinyl chloride)

Vassilis Papakonstantinou、C. D. Papaspyrides1994-12-01Journal of Vinyl Technology

Abstract There exist important industrial applications, such as hoses or plastic windows, dealing with closely combining plasticized and rigid poly(vinyl chloride). Nevertheless, migration of plasticizer causes severe variation of the mechanical performance of the end‐products. This work comprises an effort to investi…

Polymer Science and PVC

How to extract information about domain kinetics in thin ferroelectric films from switching transient current data

V. Ya. Shur、E. L. Rumyantsev、S. D. Makarov 等 4 位作者1994-12-01Integrated ferroelectrics

The paper presents the new method of mathematical treatment which allows to extract essential information about domain kinetics in polycrystal films from the traditional measurements of switching current. This information can not be obtained within the commonly used treatment. The method was verified by computer simul…

Ferroelectric and Piezoelectric MaterialsUltrasonics and Acoustic Wave PropagationAcoustic Wave Resonator Technologies

Densification and Grain Growth of Porous Alumina Compacts

Young Soo Kwon、Geonseog Son、Jeong Suh 等 4 位作者1994-12-01Journal of the American Ceramic Society

Densification and grain growth of porous alumina compacts during various high‐temperature processes were investigated. Experimental data were obtained for densification and grain growth of alumina powder during hot pressing. A set of constitutive equations was proposed based on the constitutive equations by Helle et a…

Advanced ceramic materials synthesisAluminum Alloys Composites PropertiesPowder Metallurgy Techniques and Materials

Clay Swelling and Regular Solution Theory

Ellen R. Gräber、U. Mingelgrin1994-12-01Environmental Science & Technology

ADVERTISEMENT RETURN TO ISSUEPREVArticleNEXTClay Swelling and Regular Solution TheoryEllen R. Graber and Uri. MingelgrinCite this: Environ. Sci. Technol. 1994, 28, 13, 2360–2365Publication Date (Print):December 1, 1994Publication History Published online1 May 2002Published inissue 1 December 1994https://pubs.acs.org/d…

Clay minerals and soil interactionsIron oxide chemistry and applications

Energetics of Formation and X-ray Crystal Structures of SNSNS(MF6)2 (M = As, Sb), Containing the Lattice-Stabilized, Aromatic, 6.pi. 1,3,4,2,5-Trithiadiazolium(2+) Cation Formed by the Crystal-Lattice-Enforced Symmetry-Allowed Cycloaddition of SN+ and SNS+

W. V. F. Brooks、T. Stanley Cameron、Simon Parsons 等 5 位作者1994-12-01Inorganic Chemistry

ADVERTISEMENT RETURN TO ISSUEPREVArticleNEXTEnergetics of Formation and X-ray Crystal Structures of SNSNS(MF6)2 (M = As, Sb), Containing the Lattice-Stabilized, Aromatic, 6.pi. 1,3,4,2,5-Trithiadiazolium(2+) Cation Formed by the Crystal-Lattice-Enforced Symmetry-Allowed Cycloaddition of SN+ and SNS+Wendell V. F. Brook…

Synthesis and characterization of novel inorganic/organometallic compoundsOrganic and Molecular Conductors ResearchInorganic Chemistry and Materials

Disordering and dissolution of γ’ precipitates under ion irradiation

Françoise Bourdeau、Eric Camus、C. Abromeit 等 4 位作者1994-12-01Physical review. B, Condensed matter

The stability of the \ensuremath{\gamma}' phase of the nickel-base alloy Nimonic PE16 under irradiation with ${\mathrm{Ni}}^{+}$ ions of 300-keV energy is studied by means of transmission electron microscopy. The disordering of the \ensuremath{\gamma}' phase could be followed as a function of fluence. The main finding…

Nuclear Materials and PropertiesIon-surface interactions and analysisNuclear materials and radiation effects

Effect of Polyethylene Glycol on the Coordination Sphere of Strontium in SrCl2 and Sr(NO3)2 Complexes

Robin D. Rogers、Mary L. Jezl、Cary B. Bauer1994-12-01Inorganic Chemistry

ADVERTISEMENT RETURN TO ISSUEPREVArticleNEXTEffect of Polyethylene Glycol on the Coordination Sphere of Strontium in SrCl2 and Sr(NO3)2 ComplexesRobin D. Rogers, Mary L. Jezl, and Cary B. BauerCite this: Inorg. Chem. 1994, 33, 25, 5682–5692Publication Date (Print):December 1, 1994Publication History Published online1…

Glass properties and applicationsSolid-state spectroscopy and crystallographyChemical Synthesis and Characterization