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The static polarizability and first hyperpolarizability of the water trimer anion: Ab initio study

Wei Chen、Zhi‐Ru Li、Di Wu 等 8 位作者2004-11-16The Journal of Chemical Physics

This work predicts the extraordinary hyperpolarizability of inorganic clusters: two water trimer anions. The first hyperpolarizabilities of (H2O-)(3) are considerable, beta(0)=1.715 x 10(7) a.u. for configuration A and beta(0)=1.129 x 10(7) a.u. for configuration B at MP2/d-aug-cc-pVDZ+x level. The first hyperpolariza…

Organic and Molecular Conductors ResearchSolid-state spectroscopy and crystallographyNonlinear Optical Materials Research

Crystal transformation and thermomechanical properties of poly(vinylidene fluoride)/clay nanocomposites

K. P. Pramoda、Ashiq Mohamed、In Yee Phang 等 4 位作者2004-11-16Polymer International

Abstract The crystal transformation and thermomechanical properties of melt‐intercalated poly(vinylidene fluoride) (PVDF)/clay nanocomposites are reported in this study. Thermogravimetric analysis (TGA) and differential scanning calorimetry (DSC) were used to study the thermal properties of PVDF and its nanocomposites…

Polymer crystallization and propertiesPolymer Nanocomposite Synthesis and IrradiationPolymer Nanocomposites and Properties

[Fe(sal2-trien)][Ni(dmit)2]: towards switchable spin crossover molecular conductors

St�phane Dorbes、Lydie Valade、Jos� Antonio Real 等 4 位作者2004-11-16Chemical Communications

A cooperative spin transition behaviour with a wide hysteresis loop (30 K) around 240 K has been observed, for the first time, in a salt based on the redox active [Ni(dmit)(2)](-), anion and the [Fe(sal(2)-trien)](+) spin crossover cation.

Magnetism in coordination complexesElectron Spin Resonance StudiesLanthanide and Transition Metal Complexes

Molecule-Based Photonically Switched Half-Adder

Joakim Andréasson、Gerdenis Kodis、Yuichi Terazono 等 9 位作者2004-11-16Journal of the American Chemical Society

A molecule-based binary half-adder with optical inputs and outputs has been demonstrated. The half-adder consists of two photochromic organic molecules in solution and a third-harmonic-generating crystal. One substance acts as an AND Boolean logic gate and the other as an XOR gate. Inputs are laser pulses at 1064 or 5…

Photoreceptor and optogenetics researchPhotochromic and Fluorescence ChemistryPorphyrin and Phthalocyanine Chemistry

Resonant spin-dependent electron coupling in a III-V/II-VI heterovalent double quantum well

A. A. Toropov、I. V. Sedova、S. V. Sorokin 等 6 位作者2004-11-16arXiv

We report on design, fabrication, and magnetooptical studies of a III-V/II-VI hybrid structure containing a GaAs/AlGaAs/ZnSe/ZnCdMnSe double quantum well (QW). The structure design allows one to tune the QW levels into the resonance, thus facilitating penetration of the electron wave function from the diluted magnetic…

Materials Science

Selected results and open problems in a semiclassical theory of dense matter

V. Celebonovic2004-11-16arXiv

This is a review of studies of the behaviour of materials under high pressure in Serbia in the second half of the last century.Theoretical foundations are presented,as well as some examples of the results and a selection of the open problems.

cond-mat.stat-mechMaterials Science

Low field magnetotransport in strained Si/SiGe cavities

G. Scappucci、L. Di Gaspare、F. Evangelisti 等 9 位作者2004-11-16arXiv

Low field magnetotransport revealing signatures of ballistic transport effects in strained Si/SiGe cavities is investigated. We fabricated strained Si/SiGe cavities by confining a high mobility Si/SiGe 2DEG in a bended nanowire geometry defined by electron-beam lithography and reactive ion etching. The main features o…

Materials ScienceMesoscale and Nanoscale Physics

Scaling analysis of electron transport through metal–semiconducting carbon nanotube interfaces: Evolution from the molecular limit to the bulk limit

Yongqiang Xue、Mark A. Ratner2004-11-16Physical Review B

We present a scaling analysis of electronic and transport properties of metal-semiconducting carbon nanotube interfaces as a function of the nanotube length within the coherent transport regime, which takes fully into account atomic-scale electronic structure and three-dimensional electrostatics of the metal-nanotube…

Graphene research and applicationsMolecular Junctions and NanostructuresCarbon Nanotubes in Composites

The relaxation of thermal and high-frequency transverse phonons in the semiconductor cubic crystals

I. G. Kuleyev、I. I. Kuleyev、A. P. Tankeyev 等 4 位作者2004-11-16arXiv

We have considered the relaxation of transverse thermal and high-frequency phonons for the Landau-Rumer mechanism in the semiconductor cubic crystals. Using the known values of these elastic moduli, the parameters determining the transverse phonon relaxation rates for the Landau-Rumer mechanism have been evaluated for…

Materials Science

Magnetic short range order above the Curie temperature in Fe and Ni

Vladimir Antropov2004-11-16arXiv

We report the first results of time-dependent density functional simulations of magnetic properties of Fe and Ni at finite temperatures. They reveal the existence of local moments in Ni above the Curie temperature, coupled to strong short range order. In Fe the short range order is also present to a lesser extent but…

cond-mat.stat-mechMaterials Science

An Interesting Magnetoresistive System: Sr2FeMoO6

Sugata Ray、D. D. Sarma2004-11-16arXiv

Ordered double perovskite oxides of the general formula, A2BB'O6, have been known for several decades to have interesting electronic and magnetic properties. However, a recent report of a spectacular negative magnetoresistance effect in a specific member of this family, namely Sr2FeMoO6, has brought this class of comp…

Materials Science

Nanotubular boron-carbon heterojunctions

Jens Kunstmann、Alexander Quandt2004-11-16The Journal of Chemical Physics

Linear nanotubular boron-carbon heterojunctions are systematically constructed and studied with the help of ab initio total energy calculations. The structural compatibility of the two classes of materials is shown, and a simple recipe that determines all types of stable linear junctions is illustrated in some detail.…

Boron and Carbon Nanomaterials ResearchCarbon Nanotubes in CompositesGraphene research and applications

Excitations of incoherent spin-waves due to spin-transfer torque

K. J. Lee、A. Deac、O. Redon 等 5 位作者2004-11-16arXiv

As predicted by Slonczewski and Berger, the possibility of exciting microwave oscillations in a nanomagnet by a spin-polarized current has been recently demonstrated. This observation opens very important perspectives of applications in RF components. However, some unresolved inconsistencies are found when interpretin…

Materials Science

Improvement in the Luminescence Properties and Processability of LaF3/Ln and LaPO4/Ln Nanoparticles by Surface Modification

Jan W. Stouwdam、Frank C. J. M. van Veggel2004-11-16Langmuir

The surface of lanthanide(III)-doped LaPO4 nanoparticles was modified by reaction with an alcohol, leading to a covalent bond between the ligand and the particle surface. The surface of lanthanide(III)-doped LaF3 nanoparticles was modified to alter the solubility of the nanoparticles and study the influence of surface…

Luminescence Properties of Advanced MaterialsCatalytic Processes in Materials ScienceQuantum Dots Synthesis And Properties

Photocatalytic Oxygenation of Anthracenes and Olefins with Dioxygen via Selective Radical Coupling Using 9-Mesityl-10-methylacridinium Ion as an Effective Electron-Transfer Photocatalyst

Hiroaki Kotani、Kei Ohkubo、Shunichi Fukuzumi2004-11-16Journal of the American Chemical Society

Visible light irradiation of the absorption band of 9-mesityl-10-methylacridinium ion (Acr+-Mes) in an O2-saturated acetonitrile (MeCN) solution containing 9,10-dimethylanthracene results in formation of oxygenation product, i.e., dimethylepidioxyanthracene (Me2An-O2). Anthracene and 9-methylanthracene also undergo ph…

Radical Photochemical ReactionsPorphyrin and Phthalocyanine ChemistryMetal-Catalyzed Oxygenation Mechanisms

Spider silks: recombinant synthesis, assembly, spinning, and engineering of synthetic proteins

Thomas Scheibel2004-11-16OpenAlex

Since thousands of years humans have utilized insect silks for their own benefit and comfort. The most famous example is the use of reeled silkworm silk from Bombyx mori to produce textiles. In contrast, despite the more promising properties of their silk, spiders have not been domesticated for large-scale or even ind…

Silk-based biomaterials and applicationsInvertebrate Immune Response MechanismsBiochemical and Structural Characterization

Hybrid Microgels Photoresponsive in the Near-Infrared Spectral Range

Ivan Gorelikov、Lora M. Field、Eugenia Kumacheva2004-11-16OpenAlex

We report for the first time a photothermally responsive composite material based on polymer microgel particles doped with gold nanorods. We used the dependence of the longitudinal surface plasmon of the gold nanorods on their aspect ratio to synthesize nanoparticles with strong absorption in the near-IR spectral rang…

Hydrogels: synthesis, properties, applicationsGold and Silver Nanoparticles Synthesis and ApplicationsOrbital Angular Momentum in Optics

Colloidal Gold Nanoparticles as Catalyst for Carbon−Carbon Bond Formation: Application to Aerobic Homocoupling of Phenylboronic Acid in Water

Hironori Tsunoyama、Hidehiro Sakurai、Nobuyuki Ichikuni 等 5 位作者2004-11-16OpenAlex

Gold nanoparticles (<2 nm) stabilized by poly(N-vinyl-2-pyrrolidone) (Au:PVP NPs) were prepared by reduction of AuCl4- with NaBH4 in the presence of PVP and characterized via an array of methods including optical absorption spectroscopy, transmission electron microscopy, X-ray diffraction, X-ray absorption near-edge s…

Nanocluster Synthesis and ApplicationsCatalytic Processes in Materials ScienceNanomaterials for catalytic reactions

Factors affecting the degradation and drug‐release mechanism of poly(lactic acid) and poly[(lactic acid)‐co‐(glycolic acid)]

Frank Alexis2004-11-16OpenAlex

Abstract This paper reviews the most important factors affecting the degradation and drug‐release rate of bio‐erodible polymers for better control in biomedical applications. There are several factors that influence the overall rate of degradation, in addition to pH and copolymer composition. In general, polymer degra…

Biopolymer Synthesis and ApplicationsAdvanced Polymer Synthesis and Characterizationbiodegradable polymer synthesis and properties

Structure and Function of Enzymes Adsorbed onto Single-Walled Carbon Nanotubes

Sandeep S. Karajanagi、Alexey Vertegel、Ravi S. Kane 等 4 位作者2004-11-16OpenAlex

We have examined the structure and function of two enzymes, alpha-chymotrypsin (CT) and soybean peroxidase (SBP), adsorbed onto single-walled carbon nanotubes (SWNTs). SBP retained up to 30% of its native activity upon adsorption, while the adsorbed CT retained only 1% of its native activity. Analysis of the secondary…

Carbon Nanotubes in CompositesElectrochemical sensors and biosensorsGraphene and Nanomaterials Applications