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Computer-Aided Solvent Selection for Improving the Morphology of Needle-like Crystals: A Case Study of 2,6-Dihydroxybenzoic Acid

Jie Chen、Bernhardt L. Trout2010-09-16Crystal Growth & Design

We developed a computer-aided rational solvent selection procedure for improving the morphology of needle-like crystals and applied it to 2,6-dihydroxybenzoic acid (DHB) form 2 crystals. In our procedure, a simple morphology prediction model, the Bravais−Friedel−Donnay−Harker (BFDH) model, was first applied to identif…

Computational Drug Discovery MethodsCrystallography and molecular interactionsCrystallization and Solubility Studies

Morphological Transformations and Fusion of PbSe Nanocrystals Studied Using Atomistic Simulations

Philipp Schapotschnikow、Marijn A. van Huis、H.W. Zandbergen 等 5 位作者2010-09-16Nano Letters

Molecular dynamics simulations are performed on capped and uncapped PbSe nanocrystals, employing newly developed classical interaction potentials. Here, we show that two uncapped nanocrystals fuse efficiently via direct surface attachment, even if they are initially misaligned. In sharp contrast to the general belief,…

Quantum Dots Synthesis And PropertiesChalcogenide Semiconductor Thin FilmsCopper-based nanomaterials and applications

Proliferating cell nuclear antigen in the cytoplasm interacts with components of glycolysis and cancer

Stanislav Naryzhny、Hoyun Lee2010-09-16FEBS Letters

MINT‐7995351: G3P (uniprotkb:P04406) and PCNA (uniprotkb:P12004) colocalize (MI:0403) by fluorescence microscopy (MI:0416)MINT‐7995334: ENOA (uniprotkb:P06733) and PCNA (uniprotkb:P12004) colocalize (MI:0403) by fluorescence microscopy (MI:0416)MINT‐7995368: ALDOA (uniprotkb:P04075) and PCNA (uniprotkb:P12004) colocal…

Glycosylation and Glycoproteins ResearchEnzyme Structure and FunctionSignaling Pathways in Disease

Graphene Nanoflakes: Thermal Stability, Infrared Signatures, and Potential Applications in the Field of Spintronics and Optical Nanodevices

A. M. Silva、Maíra S. Pires、V. N. Freire 等 6 位作者2010-09-16The Journal of Physical Chemistry C

We investigate the structural, electronic, and vibrational properties of graphene nanoflakes (GNFs) with a small number of atoms (<250) and distinct shapes (triangular, rectangular, and hexagonal) through classical molecular dynamics (CMD) and density functional theory (DFT) calculations. We show that these graphene n…

Graphene research and applicationsPolymer Nanocomposite Synthesis and IrradiationGraphene and Nanomaterials Applications

Modeling of Thermal Conductance at Transverse CNT−CNT Interfaces

Vikas Varshney、Soumya S. Patnaik、Ajit K. Roy 等 4 位作者2010-09-16The Journal of Physical Chemistry C

This article explores the transverse thermal conductance between two parallel—bonded as well as nonbonded—carbon nanotubes, embedded in an epoxy matrix using nonequilibrium molecular dynamics simulations. Here, we study the effect of different organic linkers—connecting the two nanotubes—on the thermal interface condu…

Carbon Nanotubes in CompositesGraphene research and applicationsThermal properties of materials

Reversible O−O Bond Cleavage and Formation between Mn(IV)-Peroxo and Mn(V)-Oxo Corroles

Sun Hee Kim、Hyejin Park、Mi Sook Seo 等 9 位作者2010-09-16Journal of the American Chemical Society

Mn(IV)-peroxo and Mn(V)-oxo corroles were synthesized and characterized with various spectroscopic techniques. The intermediates were directly used in O-O bond cleavage and formation reactions. Upon addition of proton to the Mn(IV)-peroxo corrole, the formation of the Mn(V)-oxo corrole was observed. Interestingly, add…

Photosynthetic Processes and MechanismsPorphyrin and Phthalocyanine ChemistryMetal-Catalyzed Oxygenation Mechanisms

Anti‐Hyperglycemic Properties of Crude Extract and Triterpenes from Poria cocos

Tzu-Hsuan Li、Chia-Chung Hou、Cicero Lee‐Tian Chang 等 4 位作者2010-09-16Evidence-based Complementary and Alternative Medicine

Poria cocos, Bai Fu Ling in Chinese, is used in traditional Chinese medicine to treat diabetes. However, its claimed benefits and mechanism are not fully understood. This study aimed to investigate the effect and action of P. cocos on type 2 diabetes. We first performed phytochemical analysis on the crude extract and…

Fungal Biology and ApplicationsNatural product bioactivities and synthesisPhytochemistry and Bioactive Compounds

The Electrical Properties and Conducting Mechanisms of Carbon Nanotube/Polymer Nanocomposites: A Review

Chunying Min、Xiangqian Shen、Zhou Shi 等 5 位作者2010-09-16Polymer-Plastics Technology and Engineering

This paper reviews the mechanism of the conducting process of carbon nanotubes (CNTs)-reinforced polymer nanocomposites. Comparison of the two different mechanisms, the formation of the conducting network and the hopping of the electrons, are discussed. The paper also describes the critical factors that determine perc…

Carbon Nanotubes in CompositesConducting polymers and applicationsSmart Materials for Construction

Numerical and experimental research on the influence of parameters on the tensile properties of Murata vortex yarn

Zeguang Pei、Chongwen Yu2010-09-16Journal of the Textile Institute

In this paper, a three‐dimensional numerical simulation is presented on the flow field inside the nozzle of Murata vortex spinning. Four parameters; nozzle pressure; jet orifice angle, twisting surface angle, and distance between the nozzle inlet and the spindle, are selected to investigate their influences on the air…

Textile materials and evaluationsAerosol Filtration and Electrostatic PrecipitationParticle Dynamics in Fluid Flows

Conjugated Polyelectrolyte Based Fluorescence Turn-On Assay for Real-Time Monitoring of Protease Activity

Yanyan Wang、Yong Zhang、Bin Liu2010-09-16Analytical Chemistry

A fluorescence "turn-on" assay for monitoring protease activity is developed on the basis of a water-soluble carboxylated polyfluorene derivative, PFP-CO₂Na, and its different fluorescence response toward cytochrome c (cyt c) and its fragments. PFP-CO₂Na is synthesized via Suzuki coupling polymerization between 2,7-di…

Advanced biosensing and bioanalysis techniquesMolecular Sensors and Ion DetectionLuminescence and Fluorescent Materials

Growth Patterns of Dendrimers and Electric Potential Oscillations during Electropolymerization of Pyrrole using Mono- and Mixed Surfactants

Ishwar Das、Neha Goel、Namita Rani Agrawal 等 4 位作者2010-09-16The Journal of Physical Chemistry B

Fractal and dendrimer growth patterns of polypyrrole were obtained during electrochemical polymerization of pyrrole in systems (A) pyrrole-sodium dodecyl sulfate (NaDS)-water and (B) pyrrole-NaDS-cetyl trimethyl ammonium bromide (CTAB)-water. Different morphological transitions including compact → flower-like and frac…

Organic Electronics and PhotovoltaicsConducting polymers and applicationsDendrimers and Hyperbranched Polymers

Recent progress in the synthesis and applications of nanoporous carbon films

Yousheng Tao、Morinobu Endo、Michio Inagaki 等 4 位作者2010-09-16Journal of Materials Chemistry

The synthesis and applications of thin nanoporous carbon films or membranes (NPCFs) are outlined with a focus on recent literature examples. NPCFs have large specific surface area, high electrical and thermal conductivity and both chemical and mechanical stability properties that facilitate increasing conventional use…

Supercapacitor Materials and FabricationMesoporous Materials and CatalysisCovalent Organic Framework Applications

Some Studies on the Effect of Size on Various Semiconductor Structure used in Device Design

Jatindranath Gain2010-09-16arXiv

The quantum mechanical tunneling through multiple quantum barriers is a long-standing and well-known problem. Three methods proposed earlier to calculate the tunneling probabilities and energy splitting: (1). Instanton Method (2) WKb Approximation (3) Numerical Calculation.Instaton method is helpful to understand the…

Mesoscale and Nanoscale PhysicsMaterials ScienceApplied Physicsquant-ph

Carbon nanotubes as piezoresistive microelectromechanical sensors: Theory and experiment

Michael Cullinan、Martin L. Culpepper2010-09-16Physical Review B

Carbon-nanotube (CNT) -based strain sensors have the potential to overcome some of the limitations in small-scale force/displacement sensing technologies due to their small size and high sensitivity to strain. A better understanding of the dominant and limiting causes of high strain sensitivity is needed to enable the…

Carbon Nanotubes in CompositesForce Microscopy Techniques and ApplicationsMechanical and Optical Resonators

Toward High Throughput Interconvertible Graphane-to-Graphene Growth and Patterning

Yu Wang、Xiangfan Xu、Jiong Lu 等 7 位作者2010-09-16ACS Nano

We report a new route to prepare high quality, monolayer graphene by the dehydrogenation of graphane-like film grown by plasma-enhanced chemical vapor deposition. Large-area monolayer graphane-like film is first produced by remote-discharged radio frequency plasma beam deposition at 650 °C on Cu/Ti-coated SiO(2)-Si. T…

Graphene research and applicationsSemiconductor materials and devicesRadiation Effects in Electronics

Superparamagnetic Iron Oxide Nanotheranostics for Targeted Cancer Cell Imaging and pH-Dependent Intracellular Drug Release

Peng Zou、Yanke Yu、Yuhan Wang 等 8 位作者2010-09-16Molecular Pharmaceutics

Studies were conducted to develop antibody- and fluorescence-labeled superparamagnetic iron oxide nanoparticle (SPIO) nanotheranostics for magnetic resonance imaging (MRI) and fluorescence imaging of cancer cells and pH-dependent intracellular drug release. SPIO nanoparticles (10 nm) were coated with amphiphilic polym…

Nanoparticle-Based Drug DeliveryProtein Interaction Studies and Fluorescence AnalysisCharacterization and Applications of Magnetic Nanoparticles

Spin relaxation and coherence times for electrons at the Si/SiO2 interface

S. Shankar、A. M. Tyryshkin、Jianhua He 等 4 位作者2010-09-16arXiv

While electron spins in silicon heterostructures make attractive qubits, little is known about the coherence of electrons at the Si/SiO2 interface. We report spin relaxation (T1) and coherence (T2) times for mobile electrons and natural quantum dots at a 28Si/SiO2 interface. Mobile electrons have short T1 and T2 of 0.…

Mesoscale and Nanoscale PhysicsMaterials Science

Overlapping-gate architecture for silicon Hall bar MOSFET devices in the low electron density regime

Laurens H. Willems van Beveren、Kuan Y. Tan、Nai-Shyan Lai 等 5 位作者2010-09-16arXiv

We report the fabrication and study of Hall bar MOSFET devices in which an overlapping-gate architecture allows four-terminal measurements of low-density 2D electron systems, while maintaining a high density at the ohmic contacts. Comparison with devices made using a standard single gate show that measurements can be…

Mesoscale and Nanoscale PhysicsMaterials Science

Systematic investigation of influence of n-type doping on electron spin dephasing in CdTe

D. Sprinzl、P. Horodyska、E. Belas 等 6 位作者2010-09-16arXiv

We used time-resolved Kerr rotation technique to study the electron spin coherence in a comprehensive set of bulk CdTe samples with various concentrations of electrons that were supplied by n-type doping. The electron spin coherence time of 40 ps was observed at temperature of 7 K in p-type CdTe and in n-type CdTe wit…

Materials Science