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Localized-Density-Matrix Method and Its Application to Carbon Nanotubes

WanZhen Liang、Satoshi Yokojima、DongHao Zhou 等 4 位作者1999-10-14The Journal of Physical Chemistry A

The localized-density-matrix method (Yokojima, S.; Chen, G. H. Chem. Phys. Lett . 1998, 292, 379) is employed to simulate the optical responses of very large carbon nanotubes and polyacetylene oligomers containing 10 000 carbon atoms. The Pariser−Parr−Pople Hamiltonian is used to describe the π electrons in these syst…

Carbon Nanotubes in CompositesGraphene research and applicationsFullerene Chemistry and Applications

Synthesis and characterization of novel optically active poly(amide‐imide)s

Shadpour Mallakpour、Abdol‐Reza Hajipour、Sepideh Khoee1999-10-14Polymer International

4,4′-(Hexafluoroisopropylidene)-bis-(phthalic anhydride) (1) was reacted with L-leucine (2) in toluene solution at refluxing temperature in the presence of triethylamine and the resulting imide-acid (4) was obtained in quantitative yield. The compound (4) was converted to the diacid chloride (5) by reaction with thion…

Epoxy Resin Curing ProcessesSynthesis and properties of polymersSilicone and Siloxane Chemistry

Influence of the Sol−Gel Acidic Synthesis Conditions on the Porous Texture and Acidity of SiO2−Al2O3 Catalysts with a Low Al Proportion

C. Hernandez、Alain C. Pierre1999-10-14Langmuir

The relationship between the porous texture, the coordination number of Al atoms, the type of surface acidity, and the sol−gel acidic synthesis conditions at two pH values (pH ≈ 2 and pH ≈ 0), was studied in SiO 2 −Al 2 O 3 aerogels made with a molar Si to Al ratio r Si/Al = 100. The influences of chelation of the Al…

Advanced Photocatalysis TechniquesMesoporous Materials and CatalysisAerogels and thermal insulation

Tuning of Charge Density Wave Strengths by Competition between Electron−Phonon Interaction of PdII−PdIV Mixed-Valence States and Electron Correlation of NiIII States in Quasi-One-Dimensional Bromo-Bridged Ni−Pd Mixed-Metal MX Chain Compounds Ni1-xPdx(chxn)2Br3

Masahiro Yamashita、Tomohiko Ishii、Hiroyuki Matsuzaka 等 10 位作者1999-10-14Inorganic Chemistry

A series of single crystals of quasi-one-dimensional bromo-bridged Ni-Pd mixed-metal MX chain compounds Ni(1)(-)(x)()Pd(x)()(chxn)(2)Br(3) (chxn = 1(R),2(R)-diaminocyclohexane) have been obtained by electrochemical oxidation methods of the mixed methanol solutions of parent Ni(II) complex [Ni(chxn)(2)]Br(2) and Pd(II)…

Magnetism in coordination complexesMolecular Junctions and NanostructuresOrganic and Molecular Conductors Research

Catalytic Mechanism of Phosphorylase Kinase Probed by Mutational Studies,

V.T. Skamnaki、David J. Owen、M.E.M. Noble 等 7 位作者1999-10-14Biochemistry

The contributions to catalysis of the conserved catalytic aspartate (Asp149) in the phosphorylase kinase catalytic subunit (PhK; residues 1-298) have been studied by kinetic and crystallographic methods. Kinetic studies in solvents of different viscosity show that PhK, like cyclic AMP dependent protein kinase, exhibit…

Microtubule and mitosis dynamicsCancer-related Molecular PathwaysEnzyme Structure and Function

Characterization of Plasma-Polymerized Allylamine Using Waveguide Mode Spectroscopy

Menno T. van Os、Bernhard Menges、Renate Foerch 等 5 位作者1999-10-14Chemistry of Materials

Amine-functionalized thin films were prepared by plasma-induced deposition of allylamine. Radio frequency (rf) plasma polymerization was carried out under both continuous wave (CW) and pulsed conditions to control the film chemistry. The chemical and physical nature of plasma-polymerized allylamine films was investiga…

Surface Modification and SuperhydrophobicityMetal and Thin Film MechanicsMolecular Junctions and Nanostructures

Chalcogen-Rich Lanthanide Clusters from Lanthanide Halide Starting Materials: A New Approach to the Low-Temperature Synthesis of LnSx Solids from Molecular Precursors

J.H. Melman、Mark Fitzgerald、D. Freedman 等 5 位作者1999-10-14Journal of the American Chemical Society

ADVERTISEMENT RETURN TO ISSUEPREVCommunicationNEXTChalcogen-Rich Lanthanide Clusters from Lanthanide Halide Starting Materials: A New Approach to the Low-Temperature Synthesis of LnSx Solids from Molecular PrecursorsJonathan H. Melman, Mark Fitzgerald, D. Freedman, T. J. Emge, and John G. BrennanView Author Informatio…

Quantum Dots Synthesis And PropertiesPolyoxometalates: Synthesis and ApplicationsIron-based superconductors research

Photon Avalanche in Cs 2 ZrBr 6 :Os 4+

Markus Wermuth、Hans U. Güdel1999-10-14Journal of the American Chemical Society

The 15 K visible (VIS) upconversion-luminescence of Cs 2 ZrBr 6:0.2% Os 4+ upon excitation in the near-infrared (NIR) is presented and analyzed. Crystals of Cs 2 ZrBr 6:0.2% Os 4+ were synthesized and grown by the Bridgman technique. At 15 K VIS luminescence around 16000 cm - 1 is induced by NIR excitation around 1140…

Luminescence Properties of Advanced MaterialsSolid State Laser TechnologiesOptical properties and cooling technologies in crystalline materials

Surface Modification of Silicon Nanocrystallites by Alcohols

Beata Sweryda‐Krawiec、Thierry Cassagneau、János H. Fendler1999-10-14The Journal of Physical Chemistry B

Room-temperature addition of 1-undecanol (UD-OH), 1-hexadecanol (HD-OH), 1-octanol (OC-OH), and 1,12-dodecanediol DD-(OH) 2 completely quenched the photoluminescence of silicon nanocrystallites, Si-nc. Heating Si-nc with UD-OH, HD-OH, and OC−OH resulted in the partial recovery of the photoluminescence and in the forma…

Semiconductor materials and devicesSilicon Nanostructures and PhotoluminescenceNanowire Synthesis and Applications

Transfer of Chirality from Circularly Polarized Light to a Bulk Material Property: Propagation of Photoresolution by a Liquid Crystal Transition

Kikue S. Burnham、Gary B. Schuster1999-10-14Journal of the American Chemical Society

ADVERTISEMENT RETURN TO ISSUEPREVCommunicationNEXTTransfer of Chirality from Circularly Polarized Light to a Bulk Material Property: Propagation of Photoresolution by a Liquid Crystal TransitionKikue S. Burnham and Gary B. SchusterView Author Information Department of Chemistry and Biochemistry Georgia Institute of Te…

Porphyrin and Phthalocyanine ChemistryPhotochromic and Fluorescence ChemistryMolecular spectroscopy and chirality

The First Phenalenyl-Based Neutral Radical Molecular Conductor

X. Chi、Mikhail E. Itkis、Brian O. Patrick 等 8 位作者1999-10-14Journal of the American Chemical Society

We report the preparation, crystallization, and solid-state characterization of a spiro-biphenalenyl radical. The crystal structure shows that the radical is monomeric in the solid state and without intermolecular contacts that fall within the van der Waals atomic separation. Magnetic susceptibility measurements show…

Molecular Junctions and NanostructuresSynthesis and Properties of Aromatic CompoundsOrganic and Molecular Conductors Research

Evolution of Fragments Formed at the Rupture of a Knotted Alkane Molecule

A. Marco Saitta、Michael L. Klein1999-10-14arXiv

Common experience tells us that a knot significantly weakens the polymer strand in which it is tied, which in turn leads to more facile chain rupture under tensile loading. Using first-principles molecular dynamics calculations we describe the dynamical evolution of the radicals that form after chain rupture of a sing…

Materials ScienceSoft Condensed Matterq-bio

Cauchy magnetic field component and magnitude distribution studied by the zero-field muon spin relaxation technique

X. Wan、W. J. Kossler、C. E. Stronach 等 4 位作者1999-10-14arXiv

Zero-field muon spin relaxation (ZF-$μ$SR) data for dilute spin magnetic systems have been widely interpreted with what is called a Kubo-Toyabe form based on a Lorentzian distribution of local field components. We derive here the proper magnetic field \textit{magnitude} distribution using independent and uncorrelated…

Materials Science

Monodisperse Emulsion Generation via Drop Break Off in a Coflowing Stream

Paul B. Umbanhowar、Vinay Prasad、David A. Weitz1999-10-14OpenAlex

We describe an experimental technique for the production of highly monodisperse emulsions (with minimum achievable polydispersities <3%). The phase to be dispersed is introduced into a coflowing, surfactant-laden continuous phase via a tapered capillary. Drops detach from the capillary when the streamwise forces excee…

Liquid Crystal Research AdvancementsInnovative Microfluidic and Catalytic Techniques InnovationPickering emulsions and particle stabilization

Surface Enhanced Raman Spectroscopy of Individual Rhodamine 6G Molecules on Large Ag Nanocrystals

Amy M. Michaels、M. Nirmal、Louis E. Brus1999-10-14OpenAlex

To explore the relationship between local electromagnetic field enhancement and the large SERS (surface enhanced Raman scattering) enhancement that enables the observation of single molecule Raman spectra, we measure both resonant Rayleigh scattering spectra and rhodamine 6G Raman spectra from single Ag particles. Our…

Gold and Silver Nanoparticles Synthesis and ApplicationsQuantum Dots Synthesis And PropertiesProtein Interaction Studies and Fluorescence Analysis

Magnetic behaviour of MnBi/Al/MnBi thin films

Tao Zhu、Y J Wang1999-10-13Journal of Physics D Applied Physics

MnBi/Al/MnBi thin films were prepared by using an electron-beam evaporation method then vacuum annealing. The effective magnetic anisotropy constant K eff of the MnBi/Al/MnBi thin film increases compared with MnBi thin film of similar magnetic thickness without an Al interlayer. This increase of K eff may be caused by…

Magnetic properties of thin filmsMagnetic Properties and ApplicationsMagnetic Properties of Alloys

Self-propagating high-temperature synthesis of barium-chromium ferrites BaFe12-xCrxO19(0lexle6.0)

Maxim V. Kuznetsov、L. Fernández Barquı́n、Quentin A. Pankhurst 等 4 位作者1999-10-13Journal of Physics D Applied Physics

Pure and chromium substituted barium ferrites BaFe 12- x Cr x O 19 (0 x 6.0) have been synthesised in air by self-propagating high-temperature synthesis (SHS): a combustion process involving a reaction of barium peroxide, iron oxide, chromium oxide and iron metal powder. Two series of SHS samples were produced: series…

Metallic Glasses and Amorphous AlloysMagnetic Properties and Synthesis of FerritesMagnetic Properties and Applications

Biosynthesis and Characterization of Poly(3-hydroxy-4-pentenoic acid)

Henry E. Valentin、Pierre Berger、Kenneth J. Gruys 等 7 位作者1999-10-13Macromolecules

Burkholderia sp. was grown on sucrose-containing mineral salts medium with phosphate limitation to induce poly(hydroxyalkanoate) (PHA) accumulation. Under these conditions the cultures accumulated 3-hydroxybutyric acid (3HB) and 3-hydroxy-4-pentenoic acid (3HPE) containing polyesters. Solvent fractionation of the puri…

biodegradable polymer synthesis and propertiesMicroplastics and Plastic PollutionCarbon dioxide utilization in catalysis

“Axial-Bonding”-Type Hybrid Porphyrin Arrays: Synthesis, Spectroscopy, Electrochemistry, and Singlet State Properties

Lingamallu Giribabu、T. Anita Rao、Bhaskar G. Maiya1999-10-13Inorganic Chemistry

A series of phosphorus(V), germanium(IV), and tin(IV) porphyrin-based, "axial-bonding"-type hybrid trimers have been readily constructed by employing a new "building-block" approach. The approach is modular in nature, and it involves simple "inorganic" reactions such as axial bond formation of main group element conta…

Metal complexes synthesis and propertiesMagnetism in coordination complexesPorphyrin and Phthalocyanine Chemistry

Molecular Structure−Property Relationships for Electron-Transfer Rate Attenuation in Redox-Active Core Dendrimers

Christopher B. Gorman、Jennifer C. Smith、Michael Hager 等 6 位作者1999-10-13Journal of the American Chemical Society

Two series of redox-active, iron−sulfur core dendrimers of the general structure (nBu 4 N) 2 [Fe 4 S 4 (S-Dend) 4 ] (Dend = dendrons of generations 1 through 4) were prepared. Heterogeneous electron-transfer rate constants indicated that the rigid series of dendrimers were more effective at attenuating the rate of ele…

Metal complexes synthesis and propertiesMolecular Junctions and NanostructuresDendrimers and Hyperbranched Polymers