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Infrared and Raman studies of the Verwey transition in magnetite

L. V. Gasparov、D. B. Tanner、D. B. Romero 等 6 位作者2000-09-15OpenAlex

We present infrared and Raman measurements of magnetite $({\mathrm{Fe}}_{3}{\mathrm{O}}_{4}).$ This material is known to undergo a metal-insulator and a structural transition (Verwey transition) at ${T}_{V}=120$ K. The structural aspect of the Verwey transition is disclosed by the appearance of additional infrared-act…

Magnetic Properties and Synthesis of FerritesClay minerals and soil interactionsIron oxide chemistry and applications

Low-density framework form of crystalline silicon with a wide optical band gap

J. Gryko、Paul F. McMillan、R. F. Marzke 等 7 位作者2000-09-15OpenAlex

Synthesis of a guest-free clathrate form of crystalline silicon was achieved by successive vacuum treatment and density separation of ${\mathrm{Na}}_{x}{\mathrm{Si}}_{136}$-based materials. The new allotrope of silicon has an open framework structure based upon slightly distorted tetrahedral atoms bound into five- and…

Silicon Nanostructures and PhotoluminescenceNanowire Synthesis and ApplicationsSemiconductor materials and interfaces

Rheology of Silica Dispersions in Organic Liquids: New Evidence for Solvation Forces Dictated by Hydrogen Bonding

Srinivasa R. Raghavan、Howard J. Walls、Saad A. Khan2000-09-15OpenAlex

Dispersions of hydrophilic fumed silica are investigated in a range of polar organic media. The silica forms stable, low-viscosity sols exhibiting shear thickening behavior in a host of liquids, including ethylene glycol and its oligomers and short-chain alcohols, such as n -propanol. In contrast, the silica flocculat…

Surfactants and Colloidal SystemsMesoporous Materials and CatalysisAdsorption, diffusion, and thermodynamic properties of materials

Thermopower in cobalt oxides

Wataru Koshibae、Ken‐Ichiro Tsutsui、Sadamichi Maekawa2000-09-15OpenAlex

We study theoretically the thermopower in cobalt oxides generalizing the Heikes formula. In the oxides, states of carriers are largely degenerate because the crystalline field and Hund's rule coupling compete in cobalt ions. It is shown that the degeneracy, together with strong correlation of $3d$ electrons, causes th…

Advanced Thermoelectric Materials and DevicesMagnetic and transport properties of perovskites and related materialsThermal Expansion and Ionic Conductivity

Relaxation in glassforming liquids and amorphous solids

C. A. Angell、K. L. Ngai、Gregory B. McKenna 等 5 位作者2000-09-15OpenAlex

The field of viscous liquid and glassy solid dynamics is reviewed by a process of posing the key questions that need to be answered, and then providing the best answers available to the authors and their advisors at this time. The subject is divided into four parts, three of them dealing with behavior in different dom…

Material Dynamics and PropertiesGlass properties and applicationsMetallic Glasses and Amorphous Alloys

Atomistic simulation of the effect of temperature and pressure on point defect formation in MgSiO3perovskite and the stability of CaSiO3perovskite

Graeme W. Watson、A. Wall、Stephen C. Parker2000-09-14Journal of Physics Condensed Matter

We present an atomistic simulation method for calculating the defect formation free energy and defect volume using lattice dynamics. The periodic simulation methods have been extended to allow charged systems with subtraction of defect-defect interactions to be studied routinely. This allows constant pressure minimiza…

Ferroelectric and Piezoelectric MaterialsMicrowave Dielectric Ceramics SynthesisThermal Expansion and Ionic Conductivity

Evidence of Dynamical Jahn−Teller Effect on Triphenylene Radical Cation: Resonance Raman Spectrum and ab Initio Quantum-Chemical Calculations

Tamás Keszthelyi、Gurusamy Balakrishnan、Robert Wilbrandt 等 5 位作者2000-09-14The Journal of Physical Chemistry A

We report resonance Raman spectrum of the triphenylene radical cation generated by γ-irradiation in a Freon glass at 77 K. Raman spectra were obtained using excitation in resonance with the strong cation absorption band near 400 nm. Ab initio calculations (Hartree−Fock, B-LYP, and B3-LYP, all with 6-31G basis set) wer…

Advanced Chemical Physics StudiesPhotochemistry and Electron Transfer StudiesPhase-change materials and chalcogenides

Elucidation of the Mechanism of Supramolecular Chirality Inversion in Bis(zinc porphyrin) by Dynamic Approach Using CD and 1H NMR Spectroscopy

Victor Borovkov、Juha M. Lintuluoto、Yoshihisa Inoue2000-09-14The Journal of Physical Chemistry A

Dynamic CD and 1 H NMR spectroscopies have been applied for studying the phenomenon of chirality inversion in the supramolecular system consisting of bis(Zn porphyrin) and ( R )-amine upon stepwise titration with ( S )-amine. The initially induced CD signals corresponding to the coupled B transitions of bis(Zn porphyr…

Molecular Sensors and Ion DetectionPorphyrin and Phthalocyanine ChemistryHemoglobin structure and function

The Residual Pro-Part of Cathepsin C Fulfills the Criteria Required for an Intramolecular Chaperone in Folding and Stabilizing the Human Proenzyme

Blaž Cigić、Søren Dahl、Roger H. Pain2000-09-14Biochemistry

The 13.5 kDa N-terminal part of the propeptide remains associated with mature cathepsin C after proteolytic activation and excision of the activation peptide. This residual pro-part, isolated from the recombinant enzyme, folds spontaneously and rapidly to a stable, compact monomer with secondary structure and stable t…

Protein Structure and DynamicsEnzyme Structure and FunctionSignaling Pathways in Disease

Optical spectroscopy of Pr3+in KGd(WO4)2single crystals

C. Zaldo、M. Rico、C. Cascales 等 8 位作者2000-09-14Journal of Physics Condensed Matter

The polarized optical absorption (OA) and photoluminescence of Pr 3+ doped KGd(WO 4 ) 2 (KGW) single crystals have been measured at selected temperatures between 7 and 300 K. For the studied Pr concentrations, [Pr] = 0.03 × 10 20 -1.9 × 10 20 cm -3 , a unique site is observed. 74 energy levels were experimentally dete…

Luminescence Properties of Advanced MaterialsGlass properties and applicationsSolid State Laser Technologies

Thermoplastic Elastomer Monolayers Grafted to a Functionalized Silicon Surface

Igor Luzinov、D Julthongpiput、Vladimir V. Tsukruk2000-09-14Macromolecules

We fabricated a robust ultrathin film of a triblock copolymer, poly[styrene- b -(ethylene- co -butylene)- b -styrene] (SEBS), functionalized with 2% of maleic anhydride by melt/solution grafting to a chemically reactive silicon surface. We used epoxy-terminated self-assembling monolayers to functionalize silicon surfa…

Block Copolymer Self-AssemblyAdhesion, Friction, and Surface InteractionsFluid Dynamics and Thin Films

Development and quantification of H2O2 decontamination cycles.

Volker Sigwarth、Claude Moirandat2000-09-14PubMed

Whereas correlation of physical process parameters with bacterial reduction is well established in thermal sterilisation, such a method is currently neither generally recognised nor possible for H2O2 decontamination. As a result, the efficiency and reproducibility of H2O2 decontamination and the course of the process…

Thermal and Kinetic Analysis

Matrix-Isolated Al2OF62- Ion in Molten and Solid LiF/NaF/KF

M. H. Brooker、Rolf W. Berg、J. H. von Barner 等 4 位作者2000-09-14Inorganic Chemistry

A Raman spectrum consistent with that expected from an Al2OF6(2-) ion was observed when Na2O was dissolved in a eutectic LiF/NaF/KF (FLINAK) melt at 500 degrees C, which contained a low concentration of either AlF3 or Na3AlF6. Furthermore, it was possible to trap the Al2OF6(2-) ion in the frozen solid and to measure i…

Solid-state spectroscopy and crystallographyMolten salt chemistry and electrochemical processesInorganic Fluorides and Related Compounds

Anharmonicity and disorder in simple and complex perovskites: a high energy synchrotron and hot neutron diffraction study

Jean‐Michel Kiat、Gianguido Baldinozzi、M. Dunlop 等 8 位作者2000-09-14Journal of Physics Condensed Matter

We report a study of simple ABO 3 type perovskites BaTiO 3 , PbTiO 3 , KNbO 3 , SrTiO 3 and the relaxor perovskites PbSc 1/2 Nb 1/2 O 3 (PSN) in their cubic phase using hard synchrotron radiation and hot neutrons. Gram-Charlier expansions of the thermal parameters have been performed and have revealed interesting feat…

Ferroelectric and Piezoelectric MaterialsMicrowave Dielectric Ceramics SynthesisThermal Expansion and Ionic Conductivity

A New Model for Capillary Condensation−Evaporation Hysteresis Based on a Random Corrugated Pore Structure Concept: Prediction of Intrinsic Pore Size Distribution. 2. Model Application

G.P. Androutsopoulos、Constantinos E. Salmas2000-09-14Industrial & Engineering Chemistry Research

A performance assessment of the corrugated pore structure model (CPSM), developed in part 1 ( Ind. Eng. Chem. Res. 2000, 39, 3747), is carried out through a simulation of experimental gas sorption hysteresis, covering all IUPAC versions and that of the novel MCM-41 materials. The materials studied are an anodic alumin…

Zeolite Catalysis and SynthesisMesoporous Materials and CatalysisCatalysis and Oxidation Reactions

Direct Evidence for O−H···NC Hydrogen Bonding in a Cyanide-Bridged Lanthanide−Transition-Metal Complex (H2O)6(DMF)6Ho2[Ni(CN)4]3: An Eight-Coordinated Holmium Center with a Bicapped (Square Face) Trigonal Prismatic Geometry

Bin Du、E.A. Meyers、Sheldon G. Shore2000-09-14Inorganic Chemistry

The lanthanide−transition-metal complex (H 2 O) 6 (DMF) 6 Ho 2 [Ni(CN) 4 ] 3, 1, was prepared from the reaction of Ho(NO 3 ) 3 ·6.5H 2 O with K 2 [Ni(CN) 4 ] at a 2:3 molar ratio in DMF (DMF = N, N -dimethylformamide). This compound is a model compound for studying the effects of H 2 O ligands on the coordination geom…

Organometallic Complex Synthesis and CatalysisMagnetism in coordination complexesInorganic Chemistry and Materials

Controlled Cationic Ring-Opening Polymerization of Monothiocarbonate

Nobukatsu Nemoto、Fumio Sanda、Takeshi Endo2000-09-14Macromolecules

ADVERTISEMENT RETURN TO ISSUEPREVCommunication to the...Communication to the EditorNEXTControlled Cationic Ring-Opening Polymerization of MonothiocarbonateNobukatsu Nemoto, Fumio Sanda, and Takeshi EndoView Author Information Chemical Resources Laboratory, Tokyo Institute of Technology, 4259 Nagatsuta-cho, Midori-ku,…

Advanced Polymer Synthesis and Characterizationbiodegradable polymer synthesis and propertiesSynthesis and properties of polymers

Dynamic Monte Carlo Simulation of Gelation with Extensive Cyclization

Stephen E. Rankin、Leo J. Kasehagen、Alon V. McCormick 等 4 位作者2000-09-14Macromolecules

Recent investigations have implicated cagelike precursors in the unusually high gelation conversion (∼82%) of acid-catalyzed tetraethoxysilane. However, the statistical models used so far cannot capture kinetic or composition-dependent features of alkoxysilane polycondensation. Here we take a first step toward unified…

Mesoporous Materials and CatalysisAerogels and thermal insulationSilicone and Siloxane Chemistry

Calorimetric Measurement of the Kinetics of Slow Reactions

Lee D. Hansen2000-09-14Industrial & Engineering Chemistry Research

A brief review of the application of calorimetry to measurement of the kinetics of slow processes is presented. Processes degrading or otherwise changing the properties of materials often occur too slowly to be readily measured by conventional chemical analyses but can be measured in a relatively short period of time…

Thermal and Kinetic AnalysisChemical Thermodynamics and Molecular Structurethermodynamics and calorimetric analyses

Crystal Structures and Vibrational Spectroscopy of [NBu4][Cu(CN)X] (X = Br, I) and [NBu4][Cu3(CN)4]·CH3CN

Graham A. Bowmaker、H. Hartl、Victoria Urban2000-09-14Inorganic Chemistry

The new compounds [NBu 4 ][Cu(CN)X] (X = Br ( 1 ), I ( 2 )) and [NBu 4 ][Cu 3 (CN) 4 ]·CH 3 CN ( 3 ) have been prepared by reaction of [NBu 4 ]X with CuCN in acetone ( 1, 2 ) or acetonitrile ( 3 ), and have been characterized by X-ray crystallography and vibrational spectroscopy. Compounds 1 (C 34 H 72 Br 2 Cu 2 N 4,…

Organometallic Complex Synthesis and CatalysisMagnetism in coordination complexesInorganic Chemistry and Materials