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The phase behavior of linear and partially flexible hard-sphere chain fluids and the solubility of hard spheres in hard-sphere chain fluids

Bernardo Oyarzún、Thijs van Westen、Thijs J. H. Vlugt2013-05-24The Journal of Chemical Physics

The liquid crystal phase behavior of linear and partially flexible hard-sphere chain fluids and the solubility of hard spheres in hard-sphere chain fluids are studied by constant pressure Monte Carlo simulations. An extensive study on the phase behavior of linear fluids with a length of 7, 8, 9, 10, 11, 12, 13, 14, 15…

Liquid Crystal Research AdvancementsPhase Equilibria and ThermodynamicsMaterial Dynamics and Properties

Analysis of the Hysteretic Behaviour of 3D Spin Crossover Compounds by Using an Ising‐Like Model

Daniel Chiruta、Jorge Linarès、Yann Garcia 等 5 位作者2013-05-24European Journal of Inorganic Chemistry

Abstract In this contribution, we use a recently developed Monte Carlo technique to investigate the impact of ferro‐, antiferromagnetic interactions for different thermodynamic parameters in a three‐dimensional Ising‐like model. We present the role of temperature and pressure on the first‐order phase‐transition betwee…

Theoretical and Computational PhysicsMagnetism in coordination complexesOrganic and Molecular Conductors Research

The Influence of Dissolved Carbon Dioxide on Cavitation Intensity in Ultrasound Cleaning Systems

Steven Brems、Marc Hauptmann、Elisabeth Camerotto 等 8 位作者2013-05-24Japanese Journal of Applied Physics

A study is made of the effect of dissolved CO 2 on cavitation inception and activity in an ultrasound system with a sound frequency of 928 kHz. It is shown that measurable cavitation activity is completely absent at moderate acoustic power densities (≤1.7 W cm -2 ) when only CO 2 is dissolved in ultra pure water. It i…

Fluid Dynamics and MixingUltrasound and Hyperthermia ApplicationsUltrasound and Cavitation Phenomena

Reorganizing and shaping of embedded near-coalescence silver nanoparticles with off-resonance femtosecond laser pulses

Giorgio Baraldi、J. Gonzalo、J. Solı́s 等 4 位作者2013-05-24Nanotechnology

We demonstrate that 2D distributions of non-spherical near-coalescence silver nanoparticles (NPs) embedded in an ultrathin dielectric film can be reorganized, shaped and aligned by exposure to ultrashort laser pulses. As-grown samples prepared by pulsed laser deposition show a broad absorption band with a surface plas…

Gold and Silver Nanoparticles Synthesis and ApplicationsNonlinear Optical Materials StudiesLaser-Ablation Synthesis of Nanoparticles

A New Joining Process for Magnesium Alloys: Rotation Friction Drilling Riveting

Gaokun Han、Mingxing Wang、Zhongxia Liu 等 4 位作者2013-05-24Journal of Manufacturing Science and Engineering

A new joining process for magnesium alloys, rotation friction drilling riveting (RFDR), is proposed in this paper. In RFDR operation, a semitubular rivet with a grip rod and a rivet cap rotating at high speed is brought to contact with the riveted sheets, generating frictional heat between the rivet and riveted sheets…

Magnesium Alloys: Properties and ApplicationsAluminum Alloys Composites PropertiesAdvanced Welding Techniques Analysis

From data to analysis: linking NWChem and Avogadro with the syntax and semantics of Chemical Markup Language

Wibe A. de Jong、Andrew Walker、Marcus D. Hanwell2013-05-24Journal of Cheminformatics

BACKGROUND: Multidisciplinary integrated research requires the ability to couple the diverse sets of data obtained from a range of complex experiments and computer simulations. Integrating data requires semantically rich information. In this paper an end-to-end use of semantically rich data in computational chemistry…

Computational Drug Discovery MethodsMachine Learning in Materials ScienceScientific Computing and Data Management

The influence of the rotor on surge pd testing of low voltage AC motor stator windings

Tae-June Kang、Jongman Hong、Sang Bin Lee 等 6 位作者2013-05-24IEEE Transactions on Dielectrics and Electrical Insulation

Partial discharge (PD) has been identified as one the main root causes of stator winding failures in low voltage (LV) random wound AC motors fed by PWM inverters. To ensure that PWM inverter-fed motors (type I) are PD-free under impulse excitation, the test procedure for acceptance testing of the stator insulation sys…

High voltage insulation and dielectric phenomenaPower Transformer Diagnostics and InsulationElectrostatic Discharge in Electronics

Effectiveness of micron‐sized superparamagnetic iron oxide particles as markers for detection of migration of bone marrow‐derived mesenchymal stromal cells in a stroke model

Emidio Tarulli、Joydeep D. Chaudhuri、Voytek Gretka 等 6 位作者2013-05-24Journal of Magnetic Resonance Imaging

PURPOSE: To evaluate the feasibility of using micron-sized superparamagnetic iron oxide particles (MPIOs) as an effective labeling agent for monitoring bone marrow-derived mesenchymal stromal cell (BMSC) migration in the brain using magnetic resonance imaging (MRI) in a rat model of stroke and whether the accumulation…

Nanoparticle-Based Drug DeliveryAcute Ischemic Stroke ManagementCerebrospinal fluid and hydrocephalus

Structural, Dielectric, Piezoelectric and Ferroelectric Characterization of NBT-BT Lead-Free Piezoelectric Ceramics

S. Shanmuga Sundari、Binay Kumar、R. Dhanasekaran2013-05-24IOP Conference Series Materials Science and Engineering

Lead free piezoelectric 0.94(Na 0.5 Bi 0.5 )TiO 3 -0.06BaTiO 3 (NBT-BT) ceramics were synthesized in MPB composition by conventional solid state reaction method. The crystalline nature of NBT-BT ceramic was studied by XRD and the size of the grains are determined by SEM. The X- ray diffraction results reveal that Ba 2…

Ferroelectric and Piezoelectric MaterialsAcoustic Wave Resonator TechnologiesDielectric materials and actuators

Particle swarm optimization based selection of optimal polymeric blend

R. Deepalaxmi、M. Balaji、V. Rajini2013-05-24IEEE Transactions on Dielectrics and Electrical Insulation

This paper presents a novel and efficient method to estimate the optimal blend of Silicone Rubber (SiR) and Ethylene Propylene Diene Monomer (EPDM). The SiR and EPDM are widely used insulating materials. Blending of these polymers is one way of obtaining a new material with superior properties of both. Hence blending…

High voltage insulation and dielectric phenomenaPower Transformer Diagnostics and InsulationThermal Analysis in Power Transmission

Quantification and Morphology Studies of Nanoporous Alumina Membranes: A New Algorithm for Digital Image Processing

K.S. Choudhari、P. Jidesh、P Sudheendra 等 4 位作者2013-05-24Microscopy and Microanalysis

A new mathematical algorithm is reported for the accurate and efficient analysis of pore properties of nanoporous anodic alumina (NAA) membranes using scanning electron microscope (SEM) images. NAA membranes of the desired pore size were fabricated using a two-step anodic oxidation process. Surface morphology of the N…

Advanced Machining and Optimization TechniquesAnodic Oxide Films and NanostructuresNanoporous metals and alloys

Molecular structure-dependent deformations in boron nitride nanostructures subject to an electrical field

Jin Zhang、Chengyuan Wang、Sondipon Adhikari2013-05-24Journal of Physics D Applied Physics

Based on a molecular mechanics approach pre-buckling and buckling deformations are studied for boron nitride nanotubes (BNNTs) and nanosheets (BNNSs) subject to an electrical field. Due to the reverse piezoelectric effect a compressive or shear force is generated for those of zigzag and armchair structures, respective…

Carbon Nanotubes in CompositesGraphene research and applicationsBoron and Carbon Nanomaterials Research

Effect of shed configuration on DC flashover performance of ice-covered 110 kV composite insulators

Xingliang Jiang、Bingbing Dong、Zhijin Zhang 等 5 位作者2013-05-24IEEE Transactions on Dielectrics and Electrical Insulation

Composite insulators have been used in power system for more than 20 years in China. Compared to porcelain and glass insulators, the pollution flashover performance of composite insulators is better, whereas the icing flashover performance is worse. Shed configuration is a key factor that influences flashover voltage…

High voltage insulation and dielectric phenomenaIcing and De-icing TechnologiesThermal Analysis in Power Transmission

Explicit Roles of Au and TiO 2 in a Bifunctional Au/TiO 2 Catalyst for the Water‐Gas Shift Reaction: A DFT Study

Akhtar Hussain、José Gracia、B.E. Nieuwenhuys 等 4 位作者2013-05-24ChemCatChem

Abstract The water–gas shift reaction has been investigated by using DFT applied to Au(1 0 0), stepped Au(3 1 0), and TiO 2 anatase (0 0 1) surfaces. The results show that neither Au nor TiO 2 can catalyze the reaction by themselves. Of CO, CO 2 , H 2 O, and H 2 , only CO adsorbs with moderate adsorption energy at low…

Catalytic Processes in Materials ScienceCopper-based nanomaterials and applicationsNanomaterials for catalytic reactions

Evaluation of the carcinogenicity of gallium arsenide

E. Bomhard、Heinz‐Peter Gelbke、Hermann Schenk 等 5 位作者2013-05-24Critical Reviews in Toxicology

Gallium arsenide (GaAs) is an important semiconductor material. In 2-year inhalation studies, GaAs increased the incidence of lung tumors in female rats, but not in male rats or male and female mice. Alveolar proteinosis followed by chronic active inflammation was the predominant non-neoplastic pulmonary findings. IAR…

Nanoparticles: synthesis and applicationsAir Quality and Health ImpactsArsenic contamination and mitigation

Advanced signal processing and modeling for partial discharge diagnosis on mixed power cable systems

C. Herold、Thomas Leibfried2013-05-24IEEE Transactions on Dielectrics and Electrical Insulation

Power cable grids have been growing enormously over the years; due to their aging, there is a strong need for Partial Discharge (PD) measurement techniques in order to identify incorrectly installed or damaged cable joints or cavities in cross-linked polyethylene (XLPE) insulated and paper-insulated lead-covered (PILC…

Advanced Fiber Optic SensorsHigh voltage insulation and dielectric phenomenaGeophysical Methods and Applications

3825 - INFLUENCE OF STRESS STATE AND TEMPERATURE ON THE STRENGTH OF EPOXY RESINS

Bodo Fiedler、Karl Schulte、Thomas Hobbiebrunken 等 4 位作者2013-05-24tub.dok (Hamburg University of Technology)

The yield and fracture behaviour of the neat resin was investigated. The parabolic failure criterion was applied to experimental results. From a neat resin slab, specimens for the tensile-, torsion- and compression - tests were manufactured and the failure behaviour of the neat resin due to the actual stress-state was…

Material Properties and Applications

Characterization and Antimicrobial Property of Poly(Acrylic Acid) Nanogel Containing Silver Particle Prepared by Electron Beam

Jong‐Bae Choi、Jong‐Seok Park、Myung‐Seob Khil 等 8 位作者2013-05-24International Journal of Molecular Sciences

In this study, we developed a one step process to synthesize nanogel containing silver nanoparticles involving electron beam irradiation. Water-soluble silver nitrate powder is dissolved in the distilled water and then poly(acrylic acid) (PAAc) and hexane are put into this silver nitrate solution. These samples are ir…

Nanoparticle-Based Drug DeliveryNanoparticles: synthesis and applicationsGraphene and Nanomaterials Applications

Resolution of Omeprazole Using Coupled Preferential Crystallization: Efficient Separation of a Nonracemizable Conglomerate Salt under Near-Equilibrium Conditions

Jason E. Hein、Blessing Huynh Cao、Maarten W. van der Meijden 等 5 位作者2013-05-24Organic Process Research & Development

A facile and efficient resolution of omeprazole as the monopotassium salt diethanol solvate using coupled preferential crystallization has been developed. This approach uses small perturbations in solution-phase concentration to control the competing process of selective crystal growth while suppressing unwanted prima…

Analytical Chemistry and ChromatographyOrigins and Evolution of LifeCrystallization and Solubility Studies

Effect of imidazolium ionic liquid type on the properties of nitrile rubber composites

Anna Laskowska、Anna Marzec、Gisèle Boiteux 等 6 位作者2013-05-24Polymer International

Abstract We investigated the influence of hydrophilic and hydrophobic imidazolium ionic liquids on the curing kinetic, mechanical, morphological and ionic conductivity properties of nitrile rubber composites. Two room temperature ionic liquids with a common cation—1‐ethyl‐3‐methylimidazolium thiocyanate ( EMIM SCN ; h…

Ionic liquids properties and applicationsConducting polymers and applicationsDielectric materials and actuators