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First-principles modeling of the infrared spectrum of kaolinite

Etienne Balan、A. Marco Saitta、Francesco Mauri 等 4 位作者2001-11-01American Mineralogist

The theoretical infrared spectrum of kaolinite [Al 2 Si 2 O 5 (OH) 4 , triclinic] was computed using ab initio quantum mechanical calculations. Calculations were performed using the Density Functional Theory and the generalized gradient approximation. The low-frequency dielectric tensor of kaolinite was determined as…

Clay minerals and soil interactionsGlass properties and applicationsMineralogy and Gemology Studies

An iterative procedure for the inversion of two-dimensional ion/photoelectron imaging experiments

Marc J. J. Vrakking2001-11-01Review of Scientific Instruments

We present an iterative method for the extraction of velocity and angular distributions from two-dimensional (2D) ion/photoelectron imaging experiments. This method is based on the close relationship which exists between the initial 3D angular and velocity distribution and the measured 2D angular and radial distributi…

Advanced Electron Microscopy Techniques and ApplicationsNuclear Physics and ApplicationsElectron and X-Ray Spectroscopy Techniques

Some common misconceptions concerning magnetic refrigerant materials

V. K. Pecharsky、K. A. Gschneidner2001-11-01Journal of Applied Physics

The relationships between both extensive and intensive properties quantifying the magnetocaloric effect, i.e., between the isothermal entropy change and the adiabatic temperature change, respectively, have been analyzed. An extensive measure of the magnetocaloric effect alone, without considering another important and…

Magnetic and transport properties of perovskites and related materialsRare-earth and actinide compoundsThermal Expansion and Ionic Conductivity

Structural, transport, magnetic, and thermal properties of Eu 8 Ga 16 Ge 30

S. Paschen、W. Carrillo‐Cabrera、Anders Bentien 等 7 位作者2001-11-01Physical review. B, Condensed matter

${\mathrm{Eu}}_{8}{\mathrm{Ga}}_{16}{\mathrm{Ge}}_{30}$ is the only clathrate known so far where the guest positions are fully occupied by a rare-earth element. Our investigations show that, in addition to the previously synthesized ${\mathrm{Eu}}_{8}{\mathrm{Ga}}_{16}{\mathrm{Ge}}_{30}$ modification with clathrate-I…

Advanced Thermoelectric Materials and DevicesRare-earth and actinide compoundsMagnetic and transport properties of perovskites and related materials

Identification of Gram Negative Bacteria Using Nanoscale Silicon Microcavities

Selena Chan、Scott R. Horner、Philippe M. Fauchet 等 4 位作者2001-11-01Journal of the American Chemical Society

ADVERTISEMENT RETURN TO ISSUEPREVCommunicationNEXTIdentification of Gram Negative Bacteria Using Nanoscale Silicon MicrocavitiesSelena Chan, Scott R. Horner, Philippe M. Fauchet, and Benjamin L. MillerView Author Information Center for Future Health, Department of Chemistry Department of Biochemistry and Biophysics De…

Silicon Nanostructures and PhotoluminescenceMechanical and Optical ResonatorsNanowire Synthesis and Applications

Viscoelastic and Mechanical Properties of Epoxy/Multifunctional Polyhedral Oligomeric Silsesquioxane Nanocomposites and Epoxy/Ladderlike Polyphenylsilsesquioxane Blends

Gui Zhi Li、Lichang Wang、Hossein Toghiani 等 6 位作者2001-11-01Macromolecules

Aliphatic epoxy composites with multifunctional polyhedral oligomeric silsesquioxane (POSS) ((C 6 H 5 CHCHO) 4 (Si 8 O 12 )(CH CHC 6 H 5 ) 4 ) nanophases (epoxy/POSS 95/5 and 75/25) and epoxy blends with the prepolymer of ladderlike polyphenylsilsesquioxane (PPSQ) (95/5, 90/10, and 85/15) were prepared by solution cas…

Advanced ceramic materials synthesisSilicone and Siloxane ChemistrySynthesis and characterization of novel inorganic/organometallic compounds

Grain refinement in copper under large strain deformation

Andrey Belyakov、Takuo Sakai、Hiromi Miura 等 4 位作者2001-11-01Philosophical magazine. A/Philosophical magazine. A. Physics of condensed matter. Structure, defects and mechanical properties

Structure evolution taking place in pure polycrystalline copper was studied in multiple compressions at room temperature. Rectangular samples were compressed with consequent change in the loading direction from pass to pass. The deformation behaviour at high strains of above 2 shows an apparent steadystate flow follow…

Microstructure and mechanical propertiesMicrostructure and Mechanical Properties of SteelsMetallurgy and Material Forming

Hydrogen Production by Catalytic Decomposition of Methane

Naresh Shah、P. Devadas、G.P. Huffman2001-11-01Energy & Fuels

Traditionally, hydrogen is produced by reforming or partial oxidation of methane to produce synthesis gas, followed by the water-gas shift reaction to convert CO to CO 2 and produce more hydrogen, followed in turn by a purification or separation procedure. This paper presents results for the catalytic decomposition of…

Catalysts for Methane ReformingCatalysis and Oxidation ReactionsCatalytic Processes in Materials Science

Structure and Magnetism of a Polycrystalline Transition Metal Soap − CoII[OOC(CH2)10COO](H2O)2

Jean‐Michel Rueff、Norberto Masciocchi、Pierre Rabu 等 5 位作者2001-11-01OpenAlex

Diaquacobalt(II) n-dodecane-α,ω-dioate (2) has been synthesized by metathesis of the corresponding potassium soap 1 and has been fully characterized by chemical and spectroscopic analysis. The crystal structure of 2 has been established by X-ray powder diffraction techniques combined with electron diffraction experime…

Lanthanide and Transition Metal ComplexesMagnetism in coordination complexesMetal-Organic Frameworks: Synthesis and Applications

Cavitation reactors: Efficiency assessment using a model reaction

Parag R. Gogate、Irfan Z. Shirgaonkar、M. Sivakumar 等 6 位作者2001-11-01OpenAlex

Abstract Acoustic and hydrodynamic cavitation can be used for a variety of applications ranging from biological applications such as cell disruption to chemical reactions such as oxidation of organic pollutants in aqueous effluents, including biorefractory toxic chemicals. Different equipment used for cavitational eff…

Coal Combustion and Slurry ProcessingCavitation Phenomena in PumpsUltrasound and Cavitation Phenomena

Iron(III) Spin-Crossover Compounds with a Wide Apparent Thermal Hysteresis around Room Temperature

Shinya Hayami、Zhongze Gu、H. Yoshiki 等 5 位作者2001-11-01OpenAlex

The magnetic properties of the spin-crossover compounds, [Fe(qsal)2]NCSe-MeOH (1) and [Fe(qsal)2]NCSe-CH2Cl2 (2), have been measured. We have discovered that both compounds 1 and 2 exhibit a wide thermal hysteresis loop of 140 K (T(1/2) upward arrow = 352 K and T(1/2) downward arrow = 212 K) and 180 K (T(1/2) upward a…

Metal-Catalyzed Oxygenation MechanismsLanthanide and Transition Metal ComplexesMagnetism in coordination complexes

Materials modification by electronic excitation

N. Itoh、A. M. Stoneham2001-11-01OpenAlex

Excitonic mechanisms of defect formation and of sputtering from surfaces, induced as a consequence of exciton relaxation, are effective in a limited class of wide-gap materials, such as alkali halides, alkaline earth fluorides and fused quartz. In this paper, we point out that modification by electronic excitation can…

Phase-change materials and chalcogenidesGlass properties and applicationsLuminescence Properties of Advanced Materials

Polymer Crystallization Confined in One, Two, or Three Dimensions

Yueh‐Lin Loo、Richard A. Register、Anthony J. Ryan 等 4 位作者2001-11-01OpenAlex

We examine the crystallization behavior of polyethylene- b -poly(vinylcyclohexane) diblock copolymers, E/VCH, using a combination of transmission electron microscopy (TEM), dilatometry, and time-resolved small-angle X-ray scattering (SAXS). The glassy VCH matrix effectively restricts E crystallization to within the sp…

Block Copolymer Self-AssemblyAdvanced Polymer Synthesis and CharacterizationPolymer crystallization and properties

Rational Design of Nanocomposites for Barrier Applications

А. А. Гусев、Hans Rudolf Lusti2001-11-01OpenAlex

Barrier properties of a nanocomposite comprised of perfectly aligned randomly dispersed platelets are described in this communication. The finite-element based methodology employed is generic and can readily be used to identify the role of various morphological imperfections typical of nanocomposites. The Figure shows…

Advanced Theoretical and Applied Studies in Material Sciences and GeometryMaterial Properties and ApplicationsComposite Material Mechanics

Shape Memory Alloys: A Material and a Technology

J. Van Humbeeck2001-11-01OpenAlex

Shape memory alloys offer attractive potentials such as: superelastic behaviour, reversible strains of several percent during heating or cooling over a limited temperature range, generation of high recovery stresses, and a work output with a high power/weight ratio. This paper describes the origin of those properties…

Shape Memory Alloy Transformations

Use of grating theories in integrated optics

E. Silberstein、Philippe Lalanne、Jean‐Paul Hugonin 等 4 位作者2001-11-01OpenAlex

Recently [Opt. Lett. 25, 1092 (2000)], two of the present authors proposed extending the domain of applicability of grating theories to aperiodic structures, especially the diffraction structures that are encountered in integrated optics. This extension was achieved by introduction of virtual periodicity and incorpora…

Optical Coatings and GratingsPhotonic Crystals and ApplicationsPhotonic and Optical Devices

Hydrides of the Main-Group Metals: New Variations on an Old Theme

Simon Aldridge、Anthony J. Downs2001-11-01OpenAlex

The gas-phase studies of transition metal hydrides and their coordination chemistry was presented. The synthesis of the hydrides by addition, metathesis and decomposition and elimination reactions, and the characterization of their physical, thermodynamic and vibrational properties was discussed. The studies also incl…

Advanced Chemical Physics StudiesAmmonia Synthesis and Nitrogen ReductionHydrogen Storage and Materials

Studies on the Mechanism by Which the Formation of Nanocomposites Enhances Thermal Stability

Jin Zhu、Fawn M. Uhl、Alexander B. Morgan 等 4 位作者2001-11-01OpenAlex

Polystyrene−clay and polystyrene−graphite nanocomposites have been prepared and used to explore the process by which the presence of clay or graphite in a nanocomposite enhances the thermal stability of polymers. This study has been designed to determine if the presence of paramagnetic iron in the matrix can result in…

Polymer Nanocomposites and PropertiesPolymer Nanocomposite Synthesis and IrradiationPolymer crystallization and properties

Magnetoelectric bilayer and multilayer structures of magnetostrictive and piezoelectric oxides

G. Srinivasan、Ebbe Rasmussen、J. Gallegos 等 6 位作者2001-11-01OpenAlex

Materials capable of field conversion, from magnetic to electric or vice versa, are of fundamental and technological importance. We report a giant magnetoelectric (ME) effect that results from stress-mediated electromagnetic coupling in bilayers and multilayers of nickel ferrite and lead zirconate titanate. Samples wi…

Ferroelectric and Piezoelectric MaterialsMultiferroics and related materialsSmart Materials for Construction

Polarons in crystalline and non-crystalline materials

I. G. Austin、N. F. Mott2001-11-01OpenAlex

The current state of polaron theory as applicable to transition metal oxides is reviewed, including problems such as impurity conduction where disorder plays a role. An estimate is given of the conditions under which polaron formation leads to an enhancement of the mass but no hopping energy. The binding energy of a p…

Glass properties and applicationsMagnetic and transport properties of perovskites and related materialsTransition Metal Oxide Nanomaterials