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Static properties of a simulated supercooled polymer melt: Structure factors, monomer distributions relative to the center of mass, and triple correlation functions

M. Aichele、Song‐Ho Chong、J. Baschnagel 等 4 位作者2004-06-04Physical Review E

We analyze structural and conformational properties in a simulated bead-spring model of a nonentangled, supercooled polymer melt. We explore the statics of the model via various structure factors, involving not only the monomers, but also the center of mass (CM). We find that the conformation of the chains and the CM-…

Polymer crystallization and propertiesMaterial Dynamics and PropertiesRheology and Fluid Dynamics Studies

Magnetic and magnetoelectric dynamics in RMn2O5(R = Gd and Eu)

Е. И. Головенчиц、V. A. Sanina2004-06-04Journal of Physics Condensed Matter

The dynamics of ferroelectromagnetic (multiferroic) crystals RMn 2 O 5 (R = Eu and Gd), showing magnetic and ferroelectric phase transitions with close transition temperatures (40 and 30 K for R = Eu and Gd, respectively), was studied in the frequency and temperature ranges 20–300 GHz and 5–50 K, respectively. It was…

Ferroelectric and Piezoelectric MaterialsMultiferroics and related materialsAdvanced Condensed Matter Physics

Gliadins Polymerized with Cysteine: Effects on the Physical and Water Barrier Properties of Derived Films

Pilar Hernández‐Muñoz、José M. Lagarón、Amparo López‐Rubio 等 4 位作者2004-06-04Biomacromolecules

To study the effects of disulfide bonds on certain functional properties of films made from the wheat gluten proteins gliadin and glutenin, cysteine was used to promote the formation of interchain disulfide bridges between gliadins in 70% ethanolic solution. Disulfide-mediated polymerization of gliadins was confirmed…

Nanocomposite Films for Food PackagingElectrospun Nanofibers in Biomedical ApplicationsSilk-based biomaterials and applications

A Novel Approach to Synthesizing Calcium Copper Titanate Thin Films with Giant Dielectric Constants

R. Lo Nigro、Roberta G. Toro、Graziella Malandrino 等 6 位作者2004-06-04Advanced Materials

Good quality CaCu 3 Ti 4 O 12 giant dielectric constant films have been prepared by metal–organic chemical vapor deposition on LaAlO 3 (001) substrates, using a multimetal molten precursor source. The growth of the oxide layer by a two‐step in‐situ process, namely deposition of an amorphous matrix and the consequent i…

Ferroelectric and Piezoelectric MaterialsMicrowave Dielectric Ceramics SynthesisDielectric properties of ceramics

Correlations between the structure and dielectric properties ofPb(Sc2/3W1/3)O3–Pb(Ti/Zr)O3relaxors

Pavol Juhás、Ilya Grinberg、Andrew M. Rappe 等 6 位作者2004-06-04Physical Review B

Solid solutions of $(1\ensuremath{-}x)\mathrm{Pb}({\mathrm{Sc}}_{2/3}{\mathrm{W}}_{1/3}){\mathrm{O}}_{3}--(x){\mathrm{PbTiO}}_{3}$ and $(1\ensuremath{-}x)\mathrm{Pb}({\mathrm{Sc}}_{2/3}{\mathrm{W}}_{1/3}){\mathrm{O}}_{3}--(x){\mathrm{PbZrO}}_{3}$ (PSW-PT and PSW-PZ) show remarkably different dielectric responses. Even…

Ferroelectric and Piezoelectric MaterialsMicrowave Dielectric Ceramics SynthesisThermal Expansion and Ionic Conductivity

Photoregulation of Luminescence Quenching in Photochromic Porphyrin–Phenoxynaphthacene‐ quinone Copolymers

A.J. Myles、Brian Gorodetsky、Neil R. Branda2004-06-04Advanced Materials

Fluorescence is reversibly photoregulated in high‐density random copolymers constructed from photochromic phenoxynaphthacenequinones and porphyrins (see Figure) using ring‐opening metathesis polymerization. Alternating irradiation of the polymers with ultraviolet and visible light toggles the photochromic components b…

Porphyrin and Phthalocyanine ChemistryPhotochromic and Fluorescence ChemistrySynthesis of Indole Derivatives

Adsorption, diffusion, and recombination of hydrogen on pure and boron-doped graphite surfaces

Y. Ferro、F. Marinelli、A. Jelea 等 4 位作者2004-06-04The Journal of Chemical Physics

Boron inserted as impurity by substitution of carbon atoms in graphite is known to modify the reactivity of the surface in interaction with hydrogen. Boron induces a better H retention capability in graphite while it makes easier the recombination into molecular hydrogen under heating in thermal-desorption experimenta…

Hydrogen Storage and MaterialsBoron and Carbon Nanomaterials ResearchGraphite, nuclear technology, radiation studies

Is There a Reentrant Glass in Binary Mixtures?

Emanuela Zaccarelli、Hartmut Löwen、Paul P. F. Wessels 等 6 位作者2004-06-04Physical Review Letters

By employing computer simulations for a model binary mixture, we show that a reentrant glass transition upon adding a second component occurs only if the ratio alpha of the short-time mobilities between the glass-forming component and the additive is sufficiently small. For alpha approximately 1, there is no reentrant…

Material Dynamics and PropertiesTheoretical and Computational PhysicsThermodynamic properties of mixtures

Giant Bent-Core Mesogens in the Thread Forming Process of Marine Mussels

Tue Hassenkam、Gutsmann, Thomas、Paul K. Hansma 等 5 位作者2004-06-04Biomacromolecules

In marine mussels (Mytilus), byssal threads are made in minutes from prefabricated smectic polymer liquid crystals by a process resembling reaction injection molding. The mesogens in these arrays are known to be natural block copolymers with rodlike collagen cores. Using atomic force microscopy, it was shown that thes…

Cellular Mechanics and InteractionsPolymer Surface Interaction StudiesForce Microscopy Techniques and Applications

Silica‐Templated Continuous Mesoporous Carbon Films by a Spin‐Coating Technique

Jifeng Pang、Xiang Li、Donghai Wang 等 7 位作者2004-06-04Advanced Materials

Continuous mesoporous carbon thin films (see Figure) have been synthesized through direct carbonization of sucrose/silica nanocomposite films and subsequent removal of the silica to create a mesoporous carbon network. This method provides a simple and efficient method to synthesize continuous, high surface area and po…

Supercapacitor Materials and FabricationCatalytic Processes in Materials ScienceMesoporous Materials and Catalysis

Multimode Transport in Schottky-Barrier Carbon-Nanotube Field-Effect Transistors

Joerg Appenzeller、Joachim Knoch、M. Radosavljević 等 4 位作者2004-06-04Physical Review Letters

We present a detailed study on the impact of multimode transport in carbon nanotube field-effect transistors. Under certain field conditions electrical characteristics of tube devices are a result of the contributions of more than one one-dimensional subband. Through potassium doping of the nanotube the impact of the…

Carbon Nanotubes in CompositesGraphene research and applicationsDiamond and Carbon-based Materials Research

A Two‐Stage Route to Coaxial Cubic‐Aluminum‐Nitride–Boron‐ Nitride Composite Nanotubes

L.‐W. Yin、Yoshio Bando、Yanli Zhu 等 5 位作者2004-06-04Advanced Materials

Coaxial cubic‐aluminum‐nitride–boron‐nitride composite nanotubes have been synthesized via a template‐free and catalyst‐free two‐stage route. The synthesized nanotubes have a uniform outer diameter of 50 nm and wall thickness of 15 nm, with a 2–3 nm thick BN coating. A vapor–solid (VS) mechanism is proposed for their…

Graphene research and applicationsBoron and Carbon Nanomaterials ResearchMXene and MAX Phase Materials

Coiled‐Coil Gel Nanostructures of Oligo(p‐phenylenevinylene)s: Gelation‐Induced Helix Transition in a Higher‐Order Supramolecular Self‐Assembly of a Rigid π‐Conjugated System

Subi J. George、Ayyappanpillai Ajayaghosh、Pascal Jonkheijm 等 5 位作者2004-06-04Angewandte Chemie

Linksgängig helicale Nanoseile entstehen beim Gelieren eines starren π-konjugierten Oligo(p-phenylenvinylens) mit entfernten chiralen Hanteln (siehe Bild; R=C12H25) aus Ensembles höherer Ordnung von chiralen Aggregaten. Die konzentrations- und temperaturabhängigen Änderungen der CD-Signale dieser Ensembles sind charak…

Luminescence and Fluorescent MaterialsSupramolecular Self-Assembly in MaterialsPolydiacetylene-based materials and applications

Resonance Raman spectra of uracil based on Kramers–Kronig relations using time-dependent density functional calculations and multireference perturbation theory

Johannes Neugebauer、Bernd A. Heß2004-06-04The Journal of Chemical Physics

The use of time-dependent density functional calculations for the optimization of excited-state structures and the subsequent calculation of resonance Raman intensities within the transform-theory framework is compared to calculations of Hartree-Fock/configuration interaction singles-type (CIS). The transform theory o…

Spectroscopy and Quantum Chemical StudiesAdvanced NMR Techniques and ApplicationsSolid-state spectroscopy and crystallography

A Photoinduced Spin Transition Iron(II) Complex with Liquid‐Crystal Properties

Shinya Hayami、Kazutoshi Danjobara、Katsuya Inoue 等 6 位作者2004-06-04Advanced Materials

The iron( II ) complex [Fe(3C16‐L) 2 (NCS) 2 ] (see Figure) exhibits three coexisting physical properties due to its geometric flexibility. It shows liquid‐crystal behavior in the temperature range 345–400 K, spin‐crossover behavior ( T 1/2 = 217 K) between high‐spin and low‐spin states, and photoinduced spin transiti…

Magnetism in coordination complexesLanthanide and Transition Metal ComplexesMetal-Catalyzed Oxygenation Mechanisms

Highly Organized Self‐Assembled Monolayer and Multilayer Films of Titania Nanosheets

T. Tanaka、Katsutoshi Fukuda、Yasuo Ebina 等 5 位作者2004-06-04Advanced Materials

Highly organized monolayer and multilayer films of titania nanosheets have been fabricated via electrostatic self‐assembly of large‐sized sheets and subsequent ultrasonic treatment. Overlapped or crumpled portions of the nanosheets in an as‐deposited film are effectively trimmed upon ultrasonication in a tetrabutylamm…

Polymer Surface Interaction StudiesModular Robots and Swarm IntelligenceElectrophoretic Deposition in Materials Science

All-Optical Subpicosecond Magnetic Switching in NiO(001)

Ricardo I. Gómez-Abal、O. Ney、Khompat Satitkovitchai 等 4 位作者2004-06-04Physical Review Letters

Combining optical control theory with ab initio quantum chemistry and electronic crystal field theory we explore the laser induced femtosecond spin dynamics. We propose a scenario for ultrafast all-optical magnetic switching that results from the combination of spin-orbit coupling with appropriately shaped short laser…

Diamond and Carbon-based Materials ResearchLaser-Matter Interactions and ApplicationsSpectroscopy and Quantum Chemical Studies

Resonance Raman contribution to the D band of carbon materials: Modeling defects with quantum chemistry

Fabrizia Negri、E. Donato、Matteo Tommasini 等 6 位作者2004-06-04The Journal of Chemical Physics

Polycyclic aromatic hydrocarbons (PAHs) are employed to model the Raman features that are generally associated with sp(2) nanostructures in carbon materials or with disorder and defects in graphitic materials. To this end molecular parameters (geometry changes upon electronic excitation, vibrational normal modes, and…

Carbon Nanotubes in CompositesGraphene research and applicationsDiamond and Carbon-based Materials Research

Synthesis of Single‐Crystalline ZnO Polyhedral Submicrometer‐Sized Hollow Beads Using Laser‐Assisted Growth with Ethanol Droplets as Soft Templates

Zhengyi Jiang、Zhao-Xiong Xie、Xiaohui Zhang 等 8 位作者2004-06-04Advanced Materials

A soft‐template method for the controlled synthesis of hollow beads using laser‐ assisted growth with ethanol droplets as the soft template is proposed (see Figure). Single‐crystalline ZnO polyhedral hollow beads in the range of 200–500 nm have been successfully synthesized.

ZnO doping and propertiesSurface Modification and SuperhydrophobicityPickering emulsions and particle stabilization

Nickel ferrite nanoparticles: elaboration in polyol medium via hydrolysis, and magnetic properties

S Chkoundali、Souad Ammar、N. Jouini 等 8 位作者2004-06-04Journal of Physics Condensed Matter

Ultrafine magnetic nickel ferrite NiFe2O4 particles of high crystallinity were directly prepared by forced hydrolysis of ionic iron (III) and nickel (II) solutions in 2-hydroxyethyl ether at about 478 K under atmospheric pressure. The resulting nickel ferrite particles exhibit very interesting magnetic properties: the…

Multiferroics and related materialsMagnetic Properties and Synthesis of FerritesIron oxide chemistry and applications