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The global minimum structure of SiC3: The controversy continues

Kurt W. Sattelmeyer、Henry F. Schaefer、John F. Stanton2002-06-01The Journal of Chemical Physics

The linear triplet structure of SiC3 (with terminal Si) has been investigated using coupled cluster methods, including a perturbative treatment of triple excitations, and Dunning’s correlation-consistent polarized core-valence quadrupole zeta basis set (CCSD(T)/cc-pCVQZ). Based on the demonstrated convergence with res…

Advanced Chemical Physics StudiesGraphene research and applicationsBoron and Carbon Nanomaterials Research

Raman scattering in charge-ordered Pr 0.63 Ca 0.37 MnO 3 : Anomalous temperature dependence of linewidth

R Gupta、G. Venketeswara Pai、A. K Sood 等 5 位作者2002-06-01Europhysics Letters (EPL)

We report on the evolution of the Raman-active A g phonon modes in the charge-ordered manganite Pr 0.63 Ca 0.37 MnO 3 as a function of temperature from 300 K to 25 K. Our studies reveal that the linewidths of the A g (2) and A g (4) phonons increase as temperature decreases. This anomalous temperature dependence of ph…

Magnetic and transport properties of perovskites and related materialsMultiferroics and related materialsChemical and Physical Properties of Materials

MEGAKALSILITE, A NEW POLYMORPH OF KAlSiO4 FROM THE KHIBINA ALKALINE MASSIF, KOLA PENINSULA, RUSSIA: MINERAL DESCRIPTION AND CRYSTAL STRUCTURE

A. P. Khomyakov、G. N. Nechelyustov、E. Sokolova 等 6 位作者2002-06-01The Canadian Mineralogist

Megakalsilite, KAlSiO4, hexagonal, a 18.1111(8), c 8.4619(4) Å, V 2403.7(2) Å3, c:a = 0.4672, space group P63, Z = 24, R = 0.039 (for 3255 observed reflections collected with a four-circle X-ray diffractometer), is a new mineral species from Mount Koashva, Khibina alkaline massif, Kola Peninsula, Russia. It is of pegm…

Crystal Structures and PropertiesAdvanced Condensed Matter PhysicsChemical Synthesis and Characterization

Influence of chemical structure on the mesomorphic behaviour of 3,5-disubstituted 1,2,4-oxadiazoles

S. I. Torgova、L. A. Karamysheva、A. Strigazzi2002-06-01Brazilian Journal of Physics

The correlation between chemical structure and mesomorphic properties is one of the most important problems in liquid crystals science. 3,5-Disubstituted 1,2,4-oxadiazoles are very convenient model-compounds for studying the dependence of the LC properties on the molecular design. The transition temperatures and diele…

Liquid Crystal Research AdvancementsPhotochemistry and Electron Transfer StudiesSynthesis and Properties of Aromatic Compounds

Synthesis and characterisation of carbon nitride thin films

Ian Widlow、Y. W. Chung2002-06-01International Materials Reviews

Theoretical studies of β-C3N4 and other crystalline carbon nitride structures indicate that several crystalline phases are metastable, with high bulk modulus values. There are many reports of successful synthesis of some crystalline carbon nitride phases. In spite of questionable data analysis in a significant number…

Metal and Thin Film MechanicsSemiconductor materials and devicesDiamond and Carbon-based Materials Research

Morphological and mechanical properties of polypropylene [PP]/poly(ethylene vinyl acetate) [EVA] blends. II: Polypropylene‐(ethylene‐propylene) heterophasic copolymer [PP‐EP]/EVA systems

E. Ramírez‐Vargas、Francisco J. Medellín‐Rodríguez、Dámaso Navarro‐Rodríguez 等 6 位作者2002-06-01Polymer Engineering and Science

Abstract Morphological characteristics and mechanical properties of PP‐EP/EVA blends were studied and compared to those of PP/EVA previously reported. For the PPEP/EVA blends, interfacial interactions in amorphous zones, which were associated with shifts in T g , were well defined compared to those of PP/EVA blends, a…

Polymer crystallization and propertiesPolymer Nanocomposites and Propertiesbiodegradable polymer synthesis and properties

Thermotropic biaxial nematics: [1] highly desirable materials, still elusive?

Klaüs Praefcke2002-06-01Brazilian Journal of Physics

On the basis and with the inclusion of results described in a previous paper [2], submitted for publication almost two years ago, we add some comments on very recent developments regarding both the design and synthesis of thermotropic nematogens of low-molecular weight, supposed biaxial in character, as well as puzzle…

Liquid Crystal Research AdvancementsSupramolecular Self-Assembly in MaterialsAdvanced Materials and Mechanics

Morphology development during blending of immiscible polymers in screw extruders

Sandeep Tyagi、Anup K. Ghosh2002-06-01Polymer Engineering and Science

Abstract The present work reports evolution of morphology from initial (presence of striation) to final (droplet formation) stages in a single‐screw extruder. Morphology development during the blending process controls the final size of the dispersed phase, which in turn significantly affects the properties of the ble…

Polymer crystallization and propertiesRheology and Fluid Dynamics StudiesPolymer Foaming and Composites

Where the bulk terminates: Experimental evidence for restructuring, chemibonded OH − and H + , adsorbed water and hydrocarbons on calcite surfaces

S. L. S. Stipp2002-06-01Molecular Simulation

Better understanding of mineral surface reactivity can improve control of crystal growth and dissolution which is central to biomineralisation, design of advanced materials and preventing transport of toxic substances in the environment. Some experimental observations of fundamental processes on calcite using high-res…

Calcium Carbonate Crystallization and InhibitionMinerals Flotation and Separation TechniquesCrystallization and Solubility Studies

A new radiation hard optical fiber for high-dose values

Henning Henschel、O. Köhn、Udo Weinand2002-06-01IEEE Transactions on Nuclear Science

The new Heraeus STU fiber, which is very similar to the radiation resistant Russian KS-4V fiber, was subjected to /sup 60/Co gamma irradiation tests for the first time. The results of spectral measurements (300-850 nm) as well as of measurements at 829 and 1310 nm with different dose rates were compared with those of…

Diamond and Carbon-based Materials ResearchGlass properties and applicationsSemiconductor Lasers and Optical Devices

Effect of Curvature, Contact Angle, and Interfacial Subcooling on Contact Line Spreading in a Microdrop in Dropwise Condensation

Ling Zheng、Yingxin Wang、Joel L. Plawsky 等 4 位作者2002-06-01Langmuir

The slow growth characteristics of a condensing ethanol sessile drop on a quartz substrate were studied experimentally. Using interference microscopy measurements of the transient liquid film profile (curvature) to obtain the pressure field and a Kelvin−Clapeyron model of interfacial mass flux to obtain the interfacia…

Surface Modification and SuperhydrophobicityNanomaterials and Printing TechnologiesFluid Dynamics and Thin Films

CRYSTAL CHEMISTRY OF TETRAHEDRITE SOLID-SOLUTION: EPR AND MAGNETIC INVESTIGATIONS

Francesco Di Benedetto、G. P. Bernardini、Daniele Borrini 等 9 位作者2002-06-01The Canadian Mineralogist

One hundred and thirty samples from the collection of the Natural History Museum in Florence, labeled as tetrahedrite, have
\nbeen extensively studied by means of SEM, XRD, EPMA, DTA, EPR and SQUID techniques. Wide-ranging substitutions,
\nconfirmed by compositional data, play a fundamental role in the thermal…

Iron oxide chemistry and applicationsX-ray Diffraction in CrystallographyMineralogy and Gemology Studies

Intramolecular Charge Interaction in the Radical Cations and Dications of Conjugated Tetrathiafulvalene Dimers

Masahiko Iyoda、Masashi Hasegawa、Junichi Takano 等 5 位作者2002-06-01Chemistry Letters

Abstract Dimeric TTFs have been synthesized by using palladium-catalyzed reactions. Although TTFs are very sensitive under oxidation conditions, the palladium-catalyzed reactions can be successfully employed for the oxidative coupling of TTF derivatives. The chemical oxidation of dimeric TTFs produced cation-radicals,…

Magnetism in coordination complexesOrganic and Molecular Conductors ResearchElectron Spin Resonance Studies

Global solution to a phase field model with irreversible and constrained phase evolution

Fabio Luterotti、Giulio Schimperna、Ulisse Stefanelli2002-06-01Quarterly of Applied Mathematics

This note deals with a nonlinear system of PDEs describing some irreversible phase change phenomena that account for a bounded limit velocity of the phase transition process. An existence result is established by using time discretization, compactness arguments, and techniques of subdifferential operators.

Solidification and crystal growth phenomenaStability and Controllability of Differential EquationsFluid Dynamics and Thin Films

PD pattern recognition for stator bar models with six kinds of characteristic vectors using BP network

Kai Gao、Kexiong Tan、Fuqi Li 等 4 位作者2002-06-01IEEE Transactions on Dielectrics and Electrical Insulation

The application of six different kinds of characteristic vectors to recognize PD sources is studied. Four kinds of model bars are used to simulate typical partial discharges in generator stator winding. The PD signals were measured by using a computer aided digital sampling system. The sampling results are processed b…

High voltage insulation and dielectric phenomenaPower Transformer Diagnostics and InsulationHigh-Voltage Power Transmission Systems

Crystals of Tryptophan Indole-Lyase and Tyrosine Phenol-Lyase Form Stable Quinonoid Complexes

Robert S. Phillips、Tatyana V. Demidkina、Lyudmila N. Zakomirdina 等 6 位作者2002-06-01Journal of Biological Chemistry

The binding of substrates and inhibitors to wild-type Proteus vulgaris tryptophan indole-lyase and to wild type and Y71F Citrobacter freundii tyrosine phenol-lyase was investigated in the crystalline state by polarized absorption microspectrophotometry. Oxindolyl-lalanine binds to tryptophan indole-lyase crystals to a…

Enzyme Structure and FunctionPolyamine Metabolism and ApplicationsPharmacological Effects of Natural Compounds

Synthesis and Characterization of Fe- or Cu-Substituted Molybdenum-Enriched Tungstodiphosphates

Robila Belghiche、Roland Contant、Yu Wei Lu 等 7 位作者2002-06-01European Journal of Inorganic Chemistry

Stereospecific routes were followed to synthesize five new Fe3+ and Cu2+-substituted Mo-enriched Dawson-type heteropolyanions as aqueous soluble potassium salts: α2-K7[Fe(OH2)P2W12Mo5O61] and α2-K7[Fe(OH2)P2W13Mo4O61], α1- and α2-K8[Cu(OH2)P2W12Mo5O61] and α2-K8[Cu(OH2)P2W13Mo4O61]. The substituted species as well as…

Polyoxometalates: Synthesis and ApplicationsChemical Synthesis and ReactionsChemical Synthesis and Characterization

Thiosilicate der Selten-Erd-Elemente: I. Die isotypen Verbindungen KCe[SiS4] und Eu2[SiS4]

Ingo Hartenbach、Thomas Schleid2002-06-01Zeitschrift für anorganische und allgemeine Chemie

Die beiden isotypen Thiosilicate KCe[SiS4] (a = 649, 15(6), b = 656, 18(6), c = 863, 96(8) pm, β = 107, 531(9)°) und Eu2[SiS4] (a = 651, 71(6), b = 659, 54(6), c = 821, 93(8) pm, β = 108, 437(9)°) kristallisieren monoklin in der Raumgruppe P21/m mit Z = 2. Bei der Umsetzung von KCl, Ce2S3 und SiS2 im Verhältnis 1 : 1…

Crystal Structures and PropertiesChemical Synthesis and CharacterizationInorganic Chemistry and Materials

Inhibition of the corrosion of low carbon steel in acidic solution by selected quaternary ammonium compounds

Gözen Bereket、A. Yurt2002-06-01Anti-Corrosion Methods and Materials

Potentiodynamic polarisation studies were carried out on the inhibition of low carbon steel in 0.1M hydrochloric acid solution over the temperature range 20‐60°C at different inhibitor concentrations by various quaternary ammonium salts and cationic surfactants. The inhibitors examined were tetraethyl ammonium chlorid…

Corrosion Behavior and InhibitionConcrete Corrosion and DurabilityMaterial Properties and Failure Mechanisms

Natural Ageing of Automotive Polymer Components: Characterisation of New and Used Poly(propylene) based Car Bumpers

Maria Paola Luda Di Cortemiglia、G. Ragosta、Pellegrino Musto 等 7 位作者2002-06-01Macromolecular Materials and Engineering

The chemical and morphological structure of new and post-consumer ten years old poly(propylene) based car bumpers has been investigated and their mechanical properties have been correlated to the chemical and physical degradation of the material. Poly(propylene) matrix and a rubbery ethylene-propylene phase were the c…

Polymer crystallization and propertiesbiodegradable polymer synthesis and propertiesPolymer Foaming and Composites