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Coil–Globule–Coil Transition of PNIPAm in Aqueous Methanol: Coupling All-Atom Simulations to Semi-Grand Canonical Coarse-Grained Reservoir

Debashish Mukherji、Kurt Kremer2013-11-05Macromolecules

Conformational transitions of (bio)macromolecules in aqueous mixtures are intimately linked to local concentration fluctuations of different solvent components. Though computer simulations are ideally suited to investigate such phenomena, in conventional setups the excess of one cosolvent close to the solute leads to…

Protein Structure and DynamicsMaterial Dynamics and PropertiesNMR spectroscopy and applications

Synthesis of Highly Luminescent and Photo-Stable, Graded Shell CdSe/Cd x Zn 1– x S Nanoparticles by In Situ Alloying

Klaus Boldt、Nicholas Kirkwood、Gary Beane 等 4 位作者2013-11-05Chemistry of Materials

We report a facile and robust synthesis of Cd x Zn 1– x S graded shells on CdSe nanoparticles that are prepared by interface alloying between CdS and ZnS shells at elevated temperatures. Alloying provides systematic control over the electronic structure and enables switching between Type-I and quasi -Type-II configura…

Quantum Dots Synthesis And PropertiesChalcogenide Semiconductor Thin FilmsNanocluster Synthesis and Applications

Three-Dimensional Metallic Boron Nitride

Shunhong Zhang、Qian Wang、Yoshiyuki Kawazoe 等 4 位作者2013-11-05Journal of the American Chemical Society

Boron nitride (BN) and carbon are chemical analogues of each other and share similar structures such as one-dimensional nanotubes, two-dimensional nanosheets characterized by sp(2) bonding, and three-dimensional diamond structures characterized by sp(3) bonding. However, unlike carbon which can be metallic in one, two…

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

Integrated smart electrochromic windows for energy saving and storage applications

Zhong Xie、Xiujuan Jin、Gui Chen 等 6 位作者2013-11-05Chemical Communications

A self-powered electrochromic smart window with tunable transmittance driven by dye-sensitized solar cells has been designed, which also acts as a photocharged electrochromic supercapacitor with high areal capacitance and reversible color changes.

TiO2 Photocatalysis and Solar CellsConducting polymers and applicationsTransition Metal Oxide Nanomaterials

Graphene-based polyaniline nanocomposites: preparation, properties and applications

Li Wang、Xingping Lu、Shengbin Lei 等 4 位作者2013-11-05Journal of Materials Chemistry A

Graphene is very popular in recent years, due to its unique electrical, thermal, mechanical, optical and electrochemical properties. With these useful advantages, graphene has been used as a substance to incorporate various kinds of functional materials. Among them, graphene-based polyaniline (PANI) nanocomposites hav…

Supercapacitor Materials and FabricationElectrochemical sensors and biosensorsConducting polymers and applications

Hydrogen-bonding organocatalysts for ring-opening polymerization

Coralie Thomas、Brigitte Bibal2013-11-05Green Chemistry

In the ring-opening polymerization (ROP) of cyclic esters and carbonates, hydrogen-bonding organocatalysis offers an interesting alternative to metal-based and enzymatic catalysis to access biocompatible and biodegradable polymers. The design of catalysts, strategies of activation and mechanistic elucidations are high…

Organometallic Complex Synthesis and Catalysisbiodegradable polymer synthesis and propertiesCarbon dioxide utilization in catalysis

Tuning the Ferroelectric Polarization in a Multiferroic Metal–Organic Framework

Domenico Di Sante、Alessandro Stroppa、Prashant K. Jain 等 4 位作者2013-11-05Journal of the American Chemical Society

We perform density functional theory calculations on a recently synthesized metal-organic framework (MOF) with a perovskite-like topology ABX3, i.e., [CH3CH2NH3]Mn(HCOO)3, and predict a multiferroic behavior, i.e., a coexistence of ferroelectricity and ferromagnetism. A peculiar canted ordering of the organic A-cation…

Ferroelectric and Piezoelectric MaterialsMagnetic and transport properties of perovskites and related materialsMultiferroics and related materials

Hierarchically Structured Ni3S2/Carbon Nanotube Composites as High Performance Cathode Materials for Asymmetric Supercapacitors

Chao-Shuan Dai、Pei-Yi Chien、Jeng‐Yu Lin 等 8 位作者2013-11-05ACS Applied Materials & Interfaces

The Ni3S2 nanoparticles with the diameters ranging from 10 to 80 nm are grown on the backbone of conductive multiwalled carbon nanotubes (MWCNTs) using a glucose-assisted hydrothermal method. It is found that the Ni3S2 nanoparticles deposited on MWCNTs disassemble into smaller components after the composite electrode…

Advancements in Battery MaterialsSupercapacitor Materials and FabricationAdvanced battery technologies research

Metamaterials beyond electromagnetism

Muamer Kadic、Tiemo Bückmann、Robert Schittny 等 4 位作者2013-11-05Reports on Progress in Physics

Metamaterials are rationally designed man-made structures composed of functional building blocks that are densely packed into an effective (crystalline) material. While metamaterials are mostly associated with negative refractive indices and invisibility cloaking in electromagnetism or optics, the deceptively simple m…

Metamaterials and Metasurfaces ApplicationsAcoustic Wave Phenomena ResearchEnergy Harvesting in Wireless Networks

Nematic twist-bend phase with nanoscale modulation of molecular orientation

Volodymyr Borshch、Y.-K. Kim、Jie Xiang 等 11 位作者2013-11-05Nature Communications

A state of matter in which molecules show a long-range orientational order and no positional order is called a nematic liquid crystal. The best known and most widely used (for example, in modern displays) is the uniaxial nematic, with the rod-like molecules aligned along a single axis, called the director. When the mo…

Liquid Crystal Research AdvancementsAdvanced Materials and MechanicsPlant Reproductive Biology

Steel products -- Vocabulary

作者信息未提供2013-11-04Vytautas Magnus University

77.140.01

Material Selection and PropertiesEngineering and Materials Science StudiesMetallurgy and Cultural Artifacts

Polymérisation radicalaire contrôlée par les nitroxydes en émulsion sans tensioactif pour le développement industriel de latex à morphologies variées

Émilie Groison2013-11-04OpenAlex

La synthèse de macroalcoxyamines hydrosolubles à partir d’acide méthacrylique et d’un faible pourcentage de styrène sulfonate de sodium a été étudiée en solution aqueuse. Ces macroalcoxyamines ont été utilisées comme macroamorceurs pour la polymérisation en émulsion sanstensioactif du méthacrylate de méthyle et du mét…

Hydrogels: synthesis, properties, applicationsAdvanced Polymer Synthesis and CharacterizationDendrimers and Hyperbranched Polymers

Etude moléculaire et structurale d'une intégrase rétrovirale pour le développement de nouveaux antirétroviraux et étude cristallographique d' -galactosidases thermostables issues du microorganisme Geobacillus stearothermophilus

Romain Merceron2013-11-04OpenAlex

L'intégrase (IN) est une protéine clé du cycle de réplication des rétrovirus et constitue une cible thérapeutique importante. Nous avons découvert par cristallographie aux rayons X, une nouvelle possibilité d'assemblage dimérique du domaine central catalytique de l'intégrase du Rous associated virus type I (RAV-1 IN).…

HIV/AIDS drug development and treatmentEnzyme Structure and FunctionBiochemical and Molecular Research

Modélisation de la fissuration à chaud lors du soudage de l'alliage base nickel IN600

Lionel Bouffier2013-11-04OpenAlex

La fissuration à chaud de solidification qui est l'un des problèmes majeurs rencontrés dans le cadre du soudage pourrait être préjudiciable à la tenue en service de structures mécano-soudées. Ce phénomène correspond à la formation de fissures en fin de solidification sous l'effet des déformations induites par les cont…

Advanced Welding Techniques AnalysisWelding Techniques and Residual StressesSolidification and crystal growth phenomena

Études des réactions primaires en solutions par la radiolyse pulsée picoseconde

Abdel Karim El Omar2013-11-04OpenAlex

Après la découverte des rayonnements ionisants et leurs effets chimiques, il était important d’étudier et de comprendre les mécanismes de formations des radicaux libres et des produits moléculaires caractérisés par leurs courtes durées de vie. Ceci a encouragé les groupes de recherches à développer leurs outils pour q…

Photochemistry and Electron Transfer StudiesUltrasound and Cavitation PhenomenaChemical and Physical Studies

The AC multi-harmonic magnetic susceptibility measurement setup at the LNF-INFN

Gioacchino Michael Di、Marcelli Barge A、Wang S. 等 4 位作者2013-11-04Istituto Nazionale di Fisica Nucleare. Centro Nazionale Analisi Fotogrammi

AC magnetic susceptibility measurement is a fundamental characterization tool in materials science, to study the dynamic magnetic response of magnetic materials and superconductors. An AC multi-harmonic magnetometer is available at the LAMPS laboratory of the LNF-INFN. The magnetometer allows performing experiments wi…

Physics of Superconductivity and MagnetismIron-based superconductors researchSuperconductivity in MgB2 and Alloys

Mechanisms of interaction between the components in adhesive compositions based on chloroprene rubber

Zheleva D.2013-11-04Bulgarian Portal for Open Science

The aim of this study is to investigate the mechanisms of interaction between the components in adhesive compositions based on chloroprene rubber (CR) during the formation of an adhesive joint. Investigations are made on the influence of the phenol-formaldehyde resin amount, of the rubber compounds processing regime,…

Polymer Nanocomposites and PropertiesMaterial Properties and ApplicationsPolymer Science and Applications

Deinging of recycled paper with offset printing through flotation and use of enzymes

Lasheva V.、Ilieva B.、Kotlarova S. 等 4 位作者2013-11-04Bulgarian Portal for Open Science

Use of recycled fiber material for the production of paper and paperboard has a significant share in solving problems related to environmental protection and conservation of energy resources. One of the most important processes for the paper recycling with printing press is a deinking. Perspective method for deinking…

Advanced Cellulose Research StudiesMinerals Flotation and Separation TechniquesRecycling and Waste Management Techniques

Influence of clay minerals from lateritic nickel ore in the recovery of this metal.

Eliana Satiko Mano2013-11-04LA Referencia (Red Federada de Repositorios Institucionales de Publicaciones Científicas)

O depósito de níquel laterítico de Niquelândia, GO, Brasil, é considerado um dos mais importantes depósitos desta natureza no país, em razão de sua dimensão, seus teores ligeiramente mais elevados e associação com argilominerais. Desde a década de 70, autores como Trescases e Santos já estudavam seus argilominerais de…

Metal Extraction and BioleachingClay minerals and soil interactionsBauxite Residue and Utilization

Spectral analysis from experimental data for search of geodesic low frequency modes in the TCABR Tokamak

Wilson Andres Hernandez Baquero2013-11-04LA Referencia (Red Federada de Repositorios Institucionales de Publicaciones Científicas)

O objetivo do presente estudo é a procura de evidências da presença de modos GAM nas descargas do tokamak TCABR, em distintos regimes de operação. As descargas selecionadas foram classicadas segundo a maneira de obter a melhora no connamento do plasma. Nós zemos essa procura nas descargas ôhmicas com incremento espont…

Ionosphere and magnetosphere dynamicsMagnetic confinement fusion researchFusion materials and technologies