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Docking of congo red to the surface of crystalline cellulose using molecular mechanics

Steve Woodcock、Bernard Henrissat、Junji Sugiyama1995-08-01Biopolymers

A method for the docking of ligands to crystalline surfaces using molecular mechanics was developed and applied to study the molecular features of the adsorption of Congo Red to cellulose crystals. The docking procedure was based on a grid search exploring the surface repeat unit of the cellulose crystals using severa…

Advanced Cellulose Research StudiesLignin and Wood ChemistryNanomaterials for catalytic reactions

The AC Impedance Response of the Physical Interface Between Yttria‐Stabilized Zirconia and YBa2Cu3 O 7 − x

James G. Fletcher、Anthony R. West、John T. S. Irvine1995-08-01Journal of The Electrochemical Society

Composite electrochemical cells incorporating press‐contact pellets of yttria‐stabilized zirconia (YSZ), electronically blocking electrodes, and YBa 2 Cu 3 O 7 − x ( YBCO ) were investigated by ac impedance spectroscopy. An additional element, not attributable to either of the individual components, was observed in th…

Advancements in Solid Oxide Fuel CellsIonic liquids properties and applicationsAdvanced Condensed Matter Physics

Tetragonal—Monoclinic Phase Transition Enthalpy and Temperature of ZrO 2 ‐CeO 2 Solid Solutions

Masatomo Yashima、T. Mitsuhashi、Hiroyuki Takashina 等 6 位作者1995-08-01Journal of the American Ceramic Society

DSC (differential scanning calorimeter) measurements were performed to investigate the tetragonal‐monoclinic ( t‐m ) transition enthalpy of the compositionally homogeneous ZrO 2 ‐ X mol% CeO 2 solid solution of X = 0, 4, 8, and 12. The transition enthalpy decreases linearly with an increase of CeO 2 content. The m → t…

Nuclear Materials and PropertiesThermal and Kinetic AnalysisThermal Expansion and Ionic Conductivity

Mechanically Activated MoO3. 2. Characterization of Defect Structures

Gerhard Mestl、Nathalie Verbruggen、H. Knoezinger1995-08-01Langmuir

ADVERTISEMENT RETURN TO ISSUEPREVArticleNEXTMechanically Activated MoO3. 2. Characterization of Defect StructuresG. Mestl, N. F. D. Verbruggen, and H. KnoezingerCite this: Langmuir 1995, 11, 8, 3035–3041Publication Date (Print):August 1, 1995Publication History Published online1 May 2002Published inissue 1 August 1995…

Transition Metal Oxide Nanomaterials

High yield synthesis of mixed-metal keggin polyoxoanions in non-aqueous solvents: Preparation of (n-Bu4N)4[PMW11O40] (M = V, Nb, Ta)

E. Radkov、Robert Beer1995-08-01Polyhedron

The synthesis of (n-Bu4N)4[PMW11O40] (M = V, Nb, Ta) in non-aqueous solvents is described using the lacunary compound (n-Bu4N)4H3[PW11O39] and commercially available VOCl3, NbCl5 and TaCl5. The yield and purity of the product vary depending on the solvent and the presence of base. 183W NMR spectroscopy of the title co…

biodegradable polymer synthesis and propertiesPolyoxometalates: Synthesis and ApplicationsSulfur-Based Synthesis Techniques

Thermodynamic Parameters for Cobalt-Quinone Electron Transfer and Spin Transition Steps of the CoIII(bpy)(3,5-DBSQ)(3,5-DBCat)/CoII(bpy)(3,5-DBSQ)2 Valence Tautomeric Equilibrium

Cortlandt G. Pierpont、Ok‐Sang Jung1995-08-01Inorganic Chemistry

ADVERTISEMENT RETURN TO ISSUEPREVArticleNEXTThermodynamic Parameters for Cobalt-Quinone Electron Transfer and Spin Transition Steps of the CoIII(bpy)(3,5-DBSQ)(3,5-DBCat)/CoII(bpy)(3,5-DBSQ)2 Valence Tautomeric EquilibriumCortlandt G. Pierpont and Ok-Sang JungCite this: Inorg. Chem. 1995, 34, 16, 4281–4283Publication…

Magnetism in coordination complexesPorphyrin and Phthalocyanine ChemistryPhotochemistry and Electron Transfer Studies

The [Co4O4]4+ Cubane as a Quadruply-Bridging Unit: The Mixed-Valence Cluster [Co8O4(O2CPh)12(solv)4] (solv = DMF, MeCN, H2O)

Katerina Dimitrou、Jui-Sui Sun、Kirsten Folting 等 4 位作者1995-08-01Inorganic Chemistry

ADVERTISEMENT RETURN TO ISSUEPREVArticleNEXTThe [Co4O4]4+ Cubane as a Quadruply-Bridging Unit: The Mixed-Valence Cluster [Co8O4(O2CPh)12(solv)4] (solv = DMF, MeCN, H2O)Katerina Dimitrou, Jui-Sui Sun, Kirsten Folting, and George ChristouCite this: Inorg. Chem. 1995, 34, 16, 4160–4166Publication Date (Print):August 1, 1…

Metal complexes synthesis and propertiesPolyoxometalates: Synthesis and ApplicationsNanocluster Synthesis and Applications

The Effect of Turbulence on Solidification of a Binary Metal Alloy With Electromagnetic Stirring

P. J. Prescott、F. P. Incropera1995-08-01ASME Journal of Heat and Mass Transfer

Electromagnetic induction is considered as a means of altering convection during the solidification of a Pb–19 wt pct Sn alloy. Application of a time-varying magnetic field induces Lorentz forces, which augment thermal buoyancy forces in the melt and oppose solutal buoyancy forces in the mushy zone. A continuum model…

Aluminum Alloy Microstructure PropertiesSolidification and crystal growth phenomenaMetallurgical Processes and Thermodynamics

Phonon modes and vibrational entropy of mixing in Fe-Cr

Brent Fultz、Laurence Anthony、J. L. Robertson 等 6 位作者1995-08-01Physical review. B, Condensed matter

Results from neutron inelastic-scattering experiments on Fe, Cr, and three bcc Fe-Cr alloys were analyzed with a Born--von K\'arm\'an model to obtain phonon density-of-states (DOS) curves. We compared the phonon DOS of the bcc Fe-Cr alloys to the composite phonon DOS from appropriate fractions of the phonon DOS of the…

High-pressure geophysics and materialsNuclear Materials and PropertiesNuclear Physics and Applications

Selective quinone formation by oxidation of aromatics with heteroaromatic N-oxides catalyzed by ruthenium porphyrins.

Tsunehiko Higuchi、Chika Satake、Masaaki Hirobe1995-08-01Journal of the American Chemical Society

ADVERTISEMENT RETURN TO ISSUEPREVArticleNEXTSelective quinone formation by oxidation of aromatics with heteroaromatic N-oxides catalyzed by ruthenium porphyrins.Tsunehiko Higuchi, Chika Satake, and Masaaki HirobeCite this: J. Am. Chem. Soc. 1995, 117, 34, 8879–8880Publication Date (Print):August 1, 1995Publication His…

Porphyrin and Phthalocyanine ChemistryMetal-Catalyzed Oxygenation MechanismsOxidative Organic Chemistry Reactions

Effects of Iron and Aluminium Oxides on the Colloidal and Surface Properties of Kaolin

Manuel Arias‐Estévez、María Teresa Barral、Francisco Dı́az-Fierros Viqueira1995-08-01Clays and Clay Minerals

Abstract The association between clay silicates, and iron and aluminium oxides has a major influence on the chemical and physical properties of soils. In this work the interaction of a kaolin substrate with iron and aluminium oxides and/or hydroxides obtained by basification of solutions of the metal ions was compared…

Soil and Unsaturated FlowClay minerals and soil interactionsIron oxide chemistry and applications

Kinetics and Mechanism of the Oxidation of HSO3- by O2. 1. The Uncatalyzed Reaction

Robert E. Connick、Yixue Zhang、Shaoyung Lee 等 5 位作者1995-08-01Inorganic Chemistry

ADVERTISEMENT RETURN TO ISSUEPREVArticleNEXTKinetics and Mechanism of the Oxidation of HSO3- by O2. 1. The Uncatalyzed ReactionRobert E. Connick, Yi-Xue Zhang, Shaoyung Lee, Raymond Adamic, and Paul ChiengCite this: Inorg. Chem. 1995, 34, 18, 4543–4553Publication Date (Print):August 1, 1995Publication History Publishe…

Advanced oxidation water treatmentThermal and Kinetic AnalysisIndustrial Gas Emission Control

Thermodynamic and magnetic properties of theS=1 Heisenberg chain Ni(C2H8N2)2Ni(CN)4: Experiments and theory

M. Orendáč、A. Orendáčová、Juraj Černák 等 8 位作者1995-08-01Physical review. B, Condensed matter

Specific-heat and susceptibility studies of powdered Ni(${\mathrm{C}}_{2}$${\mathrm{H}}_{8}$${\mathrm{N}}_{2}$${)}_{2}$Ni(CN${)}_{4}$ have been performed from 50 mK to 20 K, and magnetization measurements have been conducted at 4.3 K in magnetic fields up to 6 T. The results show that Ni(${\mathrm{C}}_{2}$${\mathrm{H}…

Physics of Superconductivity and MagnetismMagnetism in coordination complexesOrganic and Molecular Conductors Research

Surface-Plasmon-Polariton-Enhanced Raman Scattering from Self-Assembled Monolayers of p-Nitrothiophenol and p-Aminothiophenol on Silver

Masayuki Futamata1995-08-01The Journal of Physical Chemistry

ADVERTISEMENT RETURN TO ISSUEPREVArticleNEXTSurface-Plasmon-Polariton-Enhanced Raman Scattering from Self-Assembled Monolayers of p-Nitrothiophenol and p-Aminothiophenol on SilverMasayuki FutamataCite this: J. Phys. Chem. 1995, 99, 31, 11901–11908Publication Date (Print):August 1, 1995Publication History Published onl…

Gold and Silver Nanoparticles Synthesis and ApplicationsPlasmonic and Surface Plasmon Research

Dielectric relaxation in amorphous thin films of SrTiO3 at elevated temperatures

K. Morii、Hiroaki Kawano、Isao Fujii 等 5 位作者1995-08-01Journal of Applied Physics

Temperature and frequency dispersion of dielectric permittivity was investigated on thin amorphous films of SrTiO3 prepared by a sputtering method using neutralized argon-ion beams. The amorphous SrTiO3 films deposited on glass substrates exhibited a marked dielectric relaxation at temperatures 500–800 K in a frequenc…

Ferroelectric and Piezoelectric MaterialsSemiconductor materials and devicesDielectric properties of ceramics

Modeling the Development and Relaxation of Stresses in Films

M.D. Thouless1995-08-01Annual Review of Materials Science

The mechanics for the development and relaxation of stresses in films is briefly reviewed. The discussion initially focuses on how stresses are distributed within a film and substrate, and on the resultant deformations that these stresses induce. Although the particular case of an elastically homogeneous system with a…

Metal and Thin Film MechanicsCopper Interconnects and ReliabilityAdhesion, Friction, and Surface Interactions

Neutron Powder Diffraction Study of Molybdenum and Tungsten Dioxides

AA Bolzan、Brendan J. Kennedy、CJ Howard1995-08-01Australian Journal of Chemistry

Neutron powder diffraction data for MoO2 [P21/c, a 5.6102(3), b 4.8573(2), c 5.6265(3) ?, ß 120.915(2)°] and WO2 [P21/c, a 5.5769(2), b 4.8986(1), c 5.6644(2) ?, ß 120.678(1)] have been employed to refine structural parameters by the Rietveld method. The results confirm previous studies but have considerably greater p…

Nuclear Physics and ApplicationsX-ray Diffraction in CrystallographyInorganic Fluorides and Related Compounds

Germanium partitioning in silicon during rapid solidification

D.P. Brunco、Michael O. Thompson、David E. Hoglund 等 5 位作者1995-08-01Journal of Applied Physics

Pulsed laser melting experiments were performed on GexSi1−x alloys (x≤0.10) with regrowth velocities ranging from 0.25 to 3.9 m/s. Analysis of post-solidification Ge concentration profiles, along with time-resolved melt depth measurements, allowed determination of the liquid-phase diffusivity Dl for Ge in Si and the d…

Additive Manufacturing Materials and ProcessesSolidification and crystal growth phenomenananoparticles nucleation surface interactions

Response of epilithic diatom assemblages to water pollution in rivers in the Tokyo Metropolitan area, Japan

Eduardo A. Lobo、Kazuhiro Katoh、Yusho Aruga1995-08-01Freshwater Biology

SUMMARY 1. During the spring of 1992, fifty‐two quantitative diatom samples were collected from twenty‐eight rivers located in the Tokyo Metropolitan area, Japan, to study the response of the diatom assemblages to water pollution (assessed using physical and chemical data determined monthly from April 1987 to March 19…

Freshwater macroinvertebrate diversity and ecologySoil and Water Nutrient DynamicsDiatoms and Algae Research

Transverse interlayer order in lyotropic smectic liquid crystals

René van Roij、Peter G. Bolhuis、Bela M. Mulder 等 4 位作者1995-08-01Physical review. E, Statistical physics, plasmas, fluids, and related interdisciplinary topics

We present a theoretical and numerical study of the coupling of orientational and positional order in a smectic-A phase of hard rods. Our density functional analysis suggests a strong spatial modulation of the orientation distribution function. Computer simulations confirm this prediction and show that the modulation…

Liquid Crystal Research AdvancementsPlant and animal studiesPlant Reproductive Biology