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Theoretical Investigation of Optimized Structures of Thiolated Gold Cluster [Au25(SCH3)18]+

Takeshi Iwasa、Katsuyuki Nobusada2006-11-22The Journal of Physical Chemistry C

Geometric and electronic structures of a gold−methanethiolate [Au 25 (SCH 3 ) 18 ] + are investigated by using density functional theory. Three types of optimized structures are derived from two different Au 25 core clusters protected by 18 methanethiolates. The most probable optimized structure consists of a Au 7 cor…

Quantum Dots Synthesis And PropertiesNanocluster Synthesis and ApplicationsAdvanced Nanomaterials in Catalysis

Diffusion and Viscosity in a Crowded Environment: from Nano- to Macroscale

Jędrzej Szymański、A. Patkowski、Agnieszka Wilk 等 5 位作者2006-11-22The Journal of Physical Chemistry B

Although water is the chief component of living cells, food, and personal care products, the supramolecular components make their viscosity larger than that of water by several orders of magnitude. Using fluorescence correlation spectroscopy (FCS), photon correlation spectroscopy (PCS), NMR, and rheology data, we show…

Material Dynamics and PropertiesSurfactants and Colloidal SystemsElectrostatics and Colloid Interactions

Synthesis of well-defined copper nanocubes by a one-pot solution process

Yihai Wang、Penglei Chen、Minghua Liu2006-11-22Nanotechnology

A simple one-pot solution-phase method was developed to synthesize well-defined copper nanocubes with an edge length in the range of 100 ± 25 nm. Copper nanocubes were produced by using ascorbic acid as a reducing agent and poly(vinylpyrrolidone) (PVP) as a capping agent. X-ray diffraction (XRD), UV–vis spectroscopy (…

Gold and Silver Nanoparticles Synthesis and ApplicationsNanomaterials and Printing TechnologiesNanomaterials for catalytic reactions

Heavy‐Metal‐Ion Capture, Ion‐Exchange, and Exceptional Acid Stability of the Open‐Framework Chalcogenide (NH4)4In12Se20

Manolis J. Manos、Christos D. Malliakas、Mercouri G. Kanatzidis2006-11-22Chemistry - A European Journal

The hydrothermal synthesis of the purely inorganic open-framework indium selenide (NH(4))(4)In(12)Se(20) (1) is reported. Compound 1 exhibits a unique three-dimensional open-framework structure. The framework of 1 shows an unusual, for a chalcogenide compound, rigidity arising from the unprecedented connection mode of…

Metal-Organic Frameworks: Synthesis and ApplicationsCrystal Structures and PropertiesPolyoxometalates: Synthesis and Applications

Supramolecular Allosteric Cofacial Porphyrin Complexes

Christopher G. Oliveri、Nathan C. Gianneschi、SonBinh T. Nguyen 等 7 位作者2006-11-22Journal of the American Chemical Society

Nature routinely uses cooperative interactions to regulate cellular activity. For years, chemists have designed synthetic systems that aim toward harnessing the reactivity common to natural biological systems. By learning how to control these interactions in situ, one begins to allow for the preparation of man-made bi…

Molecular Sensors and Ion DetectionSupramolecular Chemistry and ComplexesPorphyrin and Phthalocyanine Chemistry

Low temperature magnetic transition in RuSr2EuCeCu2O10 ruthenocuprate

I. Zivkovic、D. Pajic、K. Zadro2006-11-22arXiv

A new magnetic transition in the ruthenocuprate parent compound RuSr2EuCeCu2O10 has been observed below 10 K. It shows up only as a kink in the imaginary part of the ac susceptibility and exhibits a pronounced frequency dependence. At the same time, the real part of the ac susceptibility and the dc magnetization study…

Materials ScienceStrongly Correlated Electrons

Dynamical properties of guest ions in the type-I clathrate compoundsX8Ga16Ge30(X=Eu,Sr,Ba)investigated by Raman scattering

Yuichi Takasu、Takuya Hasegawa、Norio Ogita 等 9 位作者2006-11-22Physical Review B

Raman active phonons in the type-I clathrate compounds of ${X}_{8}{\mathrm{Ga}}_{16}{\mathrm{Ge}}_{30}$ $(X=\mathrm{Eu},\mathrm{Sr},\mathrm{Ba})$ have been fully assigned by the combination of polarized Raman scattering and first principles calculations. The dynamical motions of guest ions in the $6d$-site cage have b…

High-pressure geophysics and materialsGlass properties and applicationsSolid-state spectroscopy and crystallography

Microstructural evolution and its influence on the magnetic properties ofCoFe2O4powders during mechanical milling

B. H. Liu、Jun Ding、Zhili Dong 等 6 位作者2006-11-22Physical Review B

A high coercivity of up to $5.1\phantom{\rule{0.3em}{0ex}}\mathrm{kOe}$ was induced in a large-grained ${\mathrm{CoFe}}_{2}{\mathrm{O}}_{4}$ powder after milling for a short time $(1.5\phantom{\rule{0.3em}{0ex}}\mathrm{h})$. It was found that the initial grain (particle) size played an important role in the microstruc…

Magnetic properties of thin filmsMagnetic Properties and Synthesis of FerritesMagnetic Properties of Alloys

Combined Redox Couples for Catalytic Oxidation of Methane by Dioxygen at Low Temperatures

Zengjian An、Xiulian Pan、Xiumei Liu 等 5 位作者2006-11-22Journal of the American Chemical Society

The combination of three redox couples Pd2+/Pd0-quinone/hydroquinone-NO2/NO creates an electron-transfer loop, which facilitates one-pot catalytic oxidation of methane selectively to methanol by dioxygen in CF3COOH at a temperature as low as 80 degrees C. This is the first example where an organic cocatalyst significa…

Catalytic Processes in Materials ScienceCatalysis and Oxidation ReactionsOxidative Organic Chemistry Reactions

Determination of the chiral indices (n,m) of carbon nanotubes by electron diffraction

Lu‐Chang Qin2006-11-22Physical Chemistry Chemical Physics

The atomic structure of a carbon nanotube can be defined by the chiral indices, (n,m), that specify its perimeter vector (chiral vector), with which the diameter and helicity are also determined. The fine electron beam available in a modern Transmission Electron Microscope (TEM) offers a unique and powerful probe to r…

Carbon Nanotubes in CompositesGraphene research and applicationsAdvanced Electron Microscopy Techniques and Applications

Doping and disorder in theCo2MnAlandCo2MnGahalf-metallic Heusler alloys

K. Özdoğan、E. Şaşıoğlu、B. Aktaş 等 4 位作者2006-11-22Physical Review B

We expand our study of the full-Heusler compounds [I. Galanakis et al., Appl. Phys. Lett. 89, 042502 (2006)] to cover also the case of doping and disorder in the case of ${\mathrm{Co}}_{2}\mathrm{Mn}\mathrm{Al}$ and ${\mathrm{Co}}_{2}\mathrm{Mn}\mathrm{Ga}$ half-metallic Heusler alloys. These alloys present a region o…

Advanced Welding Techniques AnalysisMXene and MAX Phase MaterialsHeusler alloys: electronic and magnetic properties

Quantum dissipation theory of slow magnetic relaxation mediated by domain-wall motion in the one-dimensional chain compound[Mn(hfac)2BNOH]

А. С. Овчинников、I. G. Bostrem、V. E. Sinitsyn 等 6 位作者2006-11-22Physical Review B

Based on a quantum dissipation theory of open systems, we present a theoretical study of slow dynamics of magnetization for the ordered state of the molecule-based magnetic complex $[\mathrm{Mn}{(\mathrm{hfac})}_{2}\mathrm{B}\mathrm{N}{\mathrm{O}}_{\mathrm{H}}]$ composed from antiferromagnetically coupled ferrimagneti…

Quantum and electron transport phenomenaTheoretical and Computational PhysicsMagnetism in coordination complexes

Strong coupling theory of the spinless charges on triangular lattices: Possible formation of a gapless charge-ordered liquid

Chisa Hotta、Nobuo Furukawa2006-11-22Physical Review B

We propose an existence of charge-ordered liquid state in the spinless fermion system on a triangular lattice under strong intersite Coulomb interactions, $V$. The classical ground state in the strong coupling limit is disordered due to geometrical frustration. The introduction of a quantum hopping term lifts the dege…

Physics of Superconductivity and MagnetismRare-earth and actinide compoundsOrganic and Molecular Conductors Research

Optoelectronic switching of addressable molecular crossbar junctions

J. C. Li2006-11-22arXiv

This letter reports on the observation of optoelectronic switching in addressable molecular crossbar junctions fabricated using polymer stamp-printing method. The active medium in the junction is a molecular self-assembled monolayer softly sandwiched between gold electrodes. The molecular junctions are investigated th…

Materials ScienceSoft Condensed Matter

Direct synthesis and structure characterization of ultrafine CeO2nanoparticles

Chenguo Hu、Zuwei Zhang、Hong Liu 等 5 位作者2006-11-22Nanotechnology

A new method to directly synthesize single-crystalline CeO 2 nanoparticles has been developed. The advantages of the method are rapid synthesis, at normal atmosphere, 100% productive ratio and low cost, with a great potential for scale-up. X-ray diffraction (XRD) spectra showed unusual peak width versus particle size,…

Catalytic Processes in Materials ScienceAdvancements in Solid Oxide Fuel CellsElectronic and Structural Properties of Oxides

Correlated metallic state of vanadium dioxide

M. M. Qazilbash、Kenneth S. Burch、Daniel Whisler 等 7 位作者2006-11-22Physical Review B

The metal-insulator transition and unconventional metallic transport in vanadium dioxide $(\mathrm{V}{\mathrm{O}}_{2})$ are investigated with a combination of spectroscopic ellipsometry and reflectance measurements. The data indicate that electronic correlations, not electron-phonon interactions, govern charge dynamic…

ZnO doping and propertiesTransition Metal Oxide NanomaterialsAdvanced Condensed Matter Physics

Synthesis of New Polyaniline/Nanotube Composites Using Ultrasonically Initiated Emulsion Polymerization

Milena Ginić‐Marković、Janis G. Matisons、Raoul Cervini 等 5 位作者2006-11-22Chemistry of Materials

Ultrasonically initiated, in situ emulsion polymerization was used to prepare multiwalled carbon nanotube/polyaniline composites (MWNTs/PANI). Transmission electron microscopy (TEM) showed that the nanotubes were coated with a PANI layer, with the thickness of this coating varying with the content of carbon nanotubes…

Carbon Nanotubes in CompositesSupercapacitor Materials and FabricationConducting polymers and applications

Tunneling Conductance of Graphene NIS Junctions

Subhro Bhattacharjee、K. Sengupta2006-11-22Physical Review Letters

We show that, in contrast with conventional normal metal-insulator-superconductor (NIS) junctions, the tunneling conductance of a NIS junction in graphene is an oscillatory function of the effective barrier strength of the insulating region, in the limit of a thin barrier. The amplitude of these oscillations is maximu…

Graphene research and applicationsQuantum and electron transport phenomenaTopological Materials and Phenomena

Entropy, diffusivity, and structural order in liquids with waterlike anomalies

Ruchi Sharma、Somendra Nath Chakraborty、Charusita Chakravarty2006-11-22The Journal of Chemical Physics

The excess entropy, defined as the difference between the entropies of the liquid and the ideal gas under identical density and temperature conditions, is studied as a function of density and temperature for liquid silica and a two-scale ramp potential, both of which are known to possess waterlike liquid state anomali…

Phase Equilibria and ThermodynamicsMaterial Dynamics and PropertiesThermodynamic properties of mixtures

Epitaxial film growth and magnetic properties ofCo2FeSi

Helmut Schneider、G. Jakob、M. Kallmayer 等 10 位作者2006-11-22Physical Review B

We have grown thin films of the Heusler compound ${\mathrm{Co}}_{2}\mathrm{Fe}\mathrm{Si}$ by RF magnetron sputtering. On (100)-oriented MgO substrates we find fully epitaxial (100)-oriented and $L{2}_{1}$ ordered growth. On ${\mathrm{Al}}_{2}{\mathrm{O}}_{3}(11\overline{2}0)$ substrates, the film growth is (110)-orie…

Magnetic and transport properties of perovskites and related materialsMXene and MAX Phase MaterialsHeusler alloys: electronic and magnetic properties