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CePS 4 Electronic Structure and Optical Properties

Gilles H. Gauthier、Stéphane Jobic、Florent Boucher 等 7 位作者1998-08-13Chemistry of Materials

The structure of CePS 4 has been determined from single-crystal X-ray diffraction data ( I 4 1 / acd space group, a = b = 10.9228(3) Å, c = 19.3998(6) Å, V = 2314.5(2) Å 3, Z = 16). The refinement, conducted from 547 independent reflections ( I > 3σ( I ) and 30 variables) led to R F (%) = 1.83 and R wF (%) = 2.36. Dif…

Solid-state spectroscopy and crystallographyCrystal Structures and PropertiesRare-earth and actinide compounds

Polymerization Conditions and Electrooptic Properties of Polymer-Stabilized Ferroelectric Liquid Crystals

C. Allan Guymon、Lisa A. Dougan、Penny J. Martens 等 6 位作者1998-08-13Chemistry of Materials

Electrooptic and optical characteristics of polymer-stabilized ferroelectric liquid crystal (PSFLC) materials prepared under different conditions were characterized. Polymerization behavior and segregation properties were also investigated. The rate of polymerization during formation of PSFLCs increases significantly…

Molecular spectroscopy and chiralityPlant Reproductive BiologyLiquid Crystal Research Advancements

Local Structures in High Pressure Phases of V2O5

Andrzej Grzechnik1998-08-13Chemistry of Materials

The high-pressure behavior of layered V 2 O 5 is investigated using in situ Raman spectroscopy in a diamond anvil cell. Upon compression, the mode associated with the vanadyl V O double bond at 997 cm - 1 softens and vanishes at about 10 GPa. Above 7 GPa, additional modes appear in the V−O stretching region, at lower…

High-pressure geophysics and materialsTransition Metal Oxide NanomaterialsCatalysis and Oxidation Reactions

Reactivity of the Verdoheme Analogues, 5-Oxaporphyrin Complexes of Cobalt(II) and Zinc(II), with Nucleophiles: Opening of the Planar Macrocycle by Alkoxide Addition To Form Helical Complexes

Lechosław Latos‐Grażyński、J.J. Johnson、S. Attar 等 5 位作者1998-08-13Inorganic Chemistry

The 5-oxaporphyrin macrocycle is a modified porphyrin (with an oxygen atom replacing a meso-methine unit) that is produced during heme degradation in biological and chemical systems. We have undertaken an investigation into the chemical reactivity of metal complexes of this macrocycle. Here we report that the diamagne…

Heme Oxygenase-1 and Carbon MonoxideHemoglobin structure and functionPorphyrin and Phthalocyanine Chemistry

Surface Sites of Alumina-Supported Molybdenum Nitride Characterized by FTIR, TPD-MS, and Volumetric Chemisorption

Shuwu Yang、Can Li、Jiang Xu 等 4 位作者1998-08-13The Journal of Physical Chemistry B

The surface state and active sites of a fresh Mo 2 N/Al 2 O 3 were investigated by FTIR, volumetric chemisorption, and TPD-MS techniques. It has been found that adsorption properties of CO on the fresh sample are quite different from those of the reduced passivated one. For reduced passivated Mo 2 N/Al 2 O 3, the IR s…

Catalysis and Hydrodesulfurization StudiesCatalysis and Oxidation ReactionsCatalytic Processes in Materials Science

Room Temperature Electrochemical Redox Reactions of the Defect Perovskite SrFeO2.5+x

A. P. Nemudry、M. Weiss、И.И. Гайнутдинов 等 5 位作者1998-08-13Chemistry of Materials

The electrochemical and chemical oxidation of the defect perovskite SrFeO 2.5 to the cubic perovskite SrFeO 3 at ambient temperature in alkaline electrolyte are shown to be in principle reversible processes with the appearance of intermediate compounds; the oxidation can be described by the formation of line phases Sr…

Magnetic and transport properties of perovskites and related materialsElectronic and Structural Properties of OxidesAdvancements in Solid Oxide Fuel Cells

A Novel Solventothermal Synthetic Route to Nanocrystalline CdE (E = S, Se, Te) and Morphological Control

Shu‐Hong Yu、Yongsheng Wu、Jian Yang 等 7 位作者1998-08-13Chemistry of Materials

A novel solventothermal route to group II−VI nanocrystalline CdE (E = S Se, Te) semiconductors has been successfully developed. The reaction can be expressed as CdC2O4 + E CdE + 2CO2↑. As-prepared CdE powders in polyamines such as ethylenediamine, diethylenetriamine, and triethylenetetraamine display rodlike morpholog…

Quantum Dots Synthesis And PropertiesChalcogenide Semiconductor Thin FilmsCopper-based nanomaterials and applications

On the Preferred Orientation and Microstructural Manipulation of Molecular Sieve Films Prepared by Secondary Growth

Anastasios Gouzinis、Michael Tsapatsis1998-08-13Chemistry of Materials

MFI-supported films were prepared using secondary growth of precursor layers. The precursor layers were prepared free of additives and no calcination step was used before secondary growth. Combined microstructural control over film thickness, orientation, continuity, and surface roughness was achieved. Hydrothermal co…

ZnO doping and propertiesCopper-based nanomaterials and applicationsQuantum Dots Synthesis And Properties

Metal-insulator transition in VO$_{2}$: a Peierls-Mott-Hubbard mechanism

Xiangyang Huang、Weidong Yang、Ulrich Eckern1998-08-13arXiv

The electronic structure of VO$_2$ is studied in the frameworks of local density approximation (LDA) and LDA+$U$ to give a quantitative description of the metal-insulator (MI) transition in this system. It is found that, both structural distortion and the local Coulomb interaction, play important roles in the transiti…

Materials ScienceStrongly Correlated Electrons

Plasticized Starch-Based Coatings To Improve Strawberry (Fragaria×Ananassa) Quality and Stability

María Alejandra García、Miriam N. Martino、Noemí Zaritzky1998-08-13Journal of Agricultural and Food Chemistry

Starch-based coatings were applied to extend storage life of strawberries ( Fragaria × ananassa ) stored at 0 °C and 84.8% relative humidity. The effects of amylose content of the starch, the type of plasticizer (glycerol and sorbitol), and the inclusion of antimicrobial agents on coating formulation were analyzed. Mi…

Nanocomposite Films for Food PackagingComposting and Vermicomposting TechniquesPostharvest Quality and Shelf Life Management

On the Growth of Highly Ordered Pores in Anodized Aluminum Oxide

Feiyue Li、Lan Zhang、Robert M. Metzger1998-08-13OpenAlex

It is now established that hexagonally ordered domain structures can be formed in anodic alumina films by repeated anodization and stripping of the porous oxide. We find that the domain size is a linear function of time and increases with temperature. The pore density is initially high but decreases with anodizing tim…

Photonic Crystals and ApplicationsAnodic Oxide Films and NanostructuresSmart Materials for Construction

Supramolecular Silver(I) Complexes with Highly Strained Polycyclic Aromatic Compounds

Megumu Munakata、Liang Wu、Takayoshi Kuroda‐Sowa 等 7 位作者1998-08-12Journal of the American Chemical Society

Four organosilver(I) complexes of polycyclic aromatic hydrocarbons (PAHs) have been investigated crystallographically. The aim was to establish whether a favorable combination of cation-π interactions and aromatic stackings might produce functional organometallic solid materials with novel networks. Complete structure…

Crystallography and molecular interactionsSupramolecular Chemistry and ComplexesOrganic and Molecular Conductors Research

Coarsening Dynamics of Crystalline Thin Films

Martin Siegert1998-08-12arXiv

The formation of pyramid-like structures in thin-film growth on substrates with a quadratic symmetry, e.g., {001} surfaces, is shown to exhibit anisotropic scaling as there exist two length scales with different time dependences. Analytical and numerical results indicate that for most realizations coarsening of mounds…

Materials Sciencecond-mat.stat-mech

Quadratic response theory for the interaction of charged particles with an electron gas

J. M. Pitarke、I. Campillo1998-08-12arXiv

A survey is presented of the theoretical status of quadratic response theories for the understanding of nonlinear aspects in the interaction of charged particles with matter. In the frame of the many-body perturbation theory we study the interaction of charged particles with the electron gas, within the random-phase a…

Materials Science

Heavy Metal Ion Adsorbents Formed by the Grafting of a Thiol Functionality to Mesoporous Silica Molecular Sieves: Factors Affecting Hg(II) Uptake

Louis Mercier、Thomas J. Pinnavaia1998-08-12OpenAlex

A new approach to heavy metal ion adsorbents based on the covalent grafting of 3-mercaptopropylsilyl groups to the framework pore walls of mesoporous silica molecular sieves has been investigated with regard to hydroxyl group densities, channel dimensions, and morphologies. Two types of silicas were examined, namely,…

Metal-Organic Frameworks: Synthesis and ApplicationsChemical Synthesis and CharacterizationMesoporous Materials and Catalysis

ChemInform Abstract: Pitting Corrosion of Metals. A Review of the Critical Factors

G. S. Frankel1998-08-11ChemInform

Abstract ChemInform is a weekly Abstracting Service, delivering concise information at a glance that was extracted from about 100 leading journals. To access a ChemInform Abstract of an article which was published elsewhere, please select a “Full Text” option. The original article is trackable via the “References” opt…

Hydrogen embrittlement and corrosion behaviors in metalsCorrosion Behavior and InhibitionConcrete Corrosion and Durability

Solvent Effects on Linear and Nonlinear Optical Properties of Donor−Acceptor Polyenes: Investigation of Electronic and Vibrational Components in Terms of Structure and Charge Distribution Changes

Roberto Cammi、Benedetta Mennucci、Jacopo Tomasi1998-08-11Journal of the American Chemical Society

We investigate the influence of solvation media upon the relationship among structure, spatial distribution of electron density, and linear and nonlinear electric properties for two series of push−pull π-conjugated molecules. The analysis is performed on both electronic and vibrational components of static polarizabil…

Photochemistry and Electron Transfer StudiesNonlinear Optical Materials ResearchSpectroscopy and Quantum Chemical Studies

Quantum point contact on graphite surface

C. Kilic、H. Mehrez、S. Ciraci1998-08-11arXiv

The conductance through a quantum point contact created by a sharp and hard metal tip on the graphite surface has features which to our knowledge have not been encountered so far in metal contacts or in nanowires. In this paper we first investigate these features which emerge from the strongly directional bonding and…

Materials Science

Fingering Instability of Dislocations and Related Defects

Ming Li、Brian B. Smith、Robin L. B. Selinger1998-08-11arXiv

We identify a fundamental morphological instability of mobile dislocations in crystals and related line defects. A positive gradient in the local driving force along the direction of defect motion destabilizes long-wavelength vibrational modes, producing a ``fingering'' pattern. The minimum unstable wavelength scales…

Materials Science

Anomalous relaxations and chemical trends at III-V nitride non-polar surfaces

Alessio Filippetti、Vincenzo Fiorentini、Giancarlo Cappellini 等 4 位作者1998-08-11arXiv

Relaxations at nonpolar surfaces of III-V compounds result from a competition between dehybridization and charge transfer. First principles calculations for the (110) and (10$\bar{1}$0) faces of zincblende and wurtzite AlN, GaN and InN reveal an anomalous behavior as compared with ordinary III-V semiconductors. Additi…

Materials Science