Search results for " Simulation"

showing 10 items of 4034 documents

Depletion-induced percolation in networks of nanorods.

2006

Above a certain density threshold, suspensions of rod-like colloidal particles form system-spanning networks. Using Monte Carlo simulations, we investigate how the depletion forces caused by spherical particles affect these networks in isotropic suspensions of rods. Although the depletion forces are strongly anisotropic and favor alignment of the rods, the percolation threshold of the rods decreases significantly. The relative size of the effect increases with the aspect ratio of the rods. The structural changes induced in the suspension by the depletant are characterized in detail and the system is compared to an ideal fluid of freely interpenetrable rods.

Materials sciencegenetic structuresEntropyMonte Carlo method: Physics [G04] [Physical chemical mathematical & earth Sciences]FOS: Physical sciencesGeneral Physics and AstronomyCondensed Matter - Soft Condensed MatterRodColloidSuspensionsComputer SimulationColloidsParticle SizeAnisotropyCondensed Matter - Materials ScienceModels StatisticalNanotubesCondensed matter physicsIsotropyElectric ConductivityMaterials Science (cond-mat.mtrl-sci)Percolation thresholdCondensed Matter::Soft Condensed Matter: Physique [G04] [Physique chimie mathématiques & sciences de la terre]Soft Condensed Matter (cond-mat.soft)AnisotropyNanorodsense organsParticle sizeMonte Carlo MethodPhysical review letters
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Carbon nanotube – Protamine hybrid: Evaluation of DNA cell penetration

2016

International audience; Carbon nanotubes (CNTs) represent a class of nanomaterials with important potential for biomedical and biotechnological applications. CNT based vectorization is an emerging approach to the transport of nucleic acid through cell membrane but limited by detachment of DNA and degradation process. To increase DNA internalization, it was proved that cationic functionalized CNT was essential. In such a way, protamine efficiently used in several transfection processes is a cationic protein which was never associated to CNT.We propose here a novel nanovector based on single-walled carbon nanotubes (SWCNT) functionalized by protamine. Our results based on qPCR methods clearly…

Materials sciencemedia_common.quotation_subjectmammalian-cellsCarbon nanotubesnoncovalent sidewall-functionalizationProtamineNanotechnology02 engineering and technologyCarbon nanotubetransportersphysicochemical propertiesin-vitro010402 general chemistryEndocytosis01 natural sciences[ CHIM ] Chemical Scienceslaw.inventionnonviral gene deliveryCell membranechemistry.chemical_compoundlawCellular internalizationmedicineendocytosis[CHIM]Chemical SciencesGeneral Materials ScienceInternalizationFunctionalizationComputingMilieux_MISCELLANEOUSmedia_commonbiologyMolecular dynamic simulationGeneral ChemistryTransfection[CHIM.MATE]Chemical Sciences/Material chemistry021001 nanoscience & nanotechnologyProtamineproteins0104 chemical sciencesdrug-deliverymedicine.anatomical_structureplasmid dnachemistryBiophysicsNucleic acidbiology.protein0210 nano-technologyNanovectorizationDNA
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A New Statistical Reconstruction Method for the Computed Tomography Using an X-Ray Tube with Flying Focal Spot

2021

Abstract This paper presents a new image reconstruction method for spiral cone- beam tomography scanners in which an X-ray tube with a flying focal spot is used. The method is based on principles related to the statistical model-based iterative reconstruction (MBIR) methodology. The proposed approach is a continuous-to-continuous data model approach, and the forward model is formulated as a shift-invariant system. This allows for avoiding a nutating reconstruction-based approach, e.g. the advanced single slice rebinning methodology (ASSR) that is usually applied in computed tomography (CT) scanners with X-ray tubes with a flying focal spot. In turn, the proposed approach allows for signific…

Materials sciencemedicine.diagnostic_testbusiness.industryComputed tomographyX-ray tubeReconstruction methodlaw.inventionOpticsArtificial IntelligenceHardware and ArchitecturelawModeling and SimulationFocal spotmedicineComputer Vision and Pattern RecognitionbusinessInformation SystemsJournal of Artificial Intelligence and Soft Computing Research
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Micro-cracking of brittle polycrystalline materials with initial damage

2016

In this paper, the effect of pre-existing damage on brittle micro-cracking of polycrystalline materials is explored. The behaviour of single and multiple cracks randomly distributed within a grain scale polycrystalline aggregate is investigated using a recently developed grain boundary 3D computational framework. Each grain is modelled as a single crystal anisotropic domain. Opening, sliding and/or contact at grain boundaries are modelled using nonlinear cohesive-frictional laws. The polycrystalline micro-morphologies are generated using Voronoi tessellation algorithms in combination with a regularisation scheme to avoid the presence of unnecessary small geometrical entities (edges and face…

Materials sciencemicro-mechanicrepresentative volume element02 engineering and technology01 natural sciencesboundary element methodBrittleness0203 mechanical engineeringPolycrystalline materialMechanics of Material0101 mathematicsBoundary element methodbusiness.industryMechanical EngineeringMicromechanicsStructural engineeringMechanicsStrength of materials010101 applied mathematics020303 mechanical engineering & transportsMechanics of Materialsmicro-crackingModeling and SimulationRepresentative elementary volumeGrain boundaryCrystallitebusinessSingle crystal
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Limits of stability in supported graphene nanoribbons subject to bending

2016

Graphene nanoribbons are prone to in-plane bending even when supported on flat substrates. However, the amount of bending that ribbons can stably withstand remains poorly known. Here, by using molecular dynamics simulations, we study the stability limits of 0.5-1.9 nm wide armchair and zigzag graphene nanoribbons subject to bending. We observe that the limits for maximum stable curvatures are below ~10 deg/nm, in case the bending is externally forced and the limit is caused by buckling instability. Furthermore, it turns out that the limits for maximum stable curvatures are also below ~10 deg/nm, in case the bending is not forced and the limit arises only from the corrugated potential energy…

Materials sciencestability limitsFOS: Physical sciencesNanotechnology02 engineering and technologyLimits of stability01 natural sciencesPotential energy landscapeMolecular dynamicsMesoscale and Nanoscale Physics (cond-mat.mes-hall)0103 physical sciencesElasticity (economics)010306 general physicsta114Condensed Matter - Mesoscale and Nanoscale PhysicsCondensed matter physicsmolecular dynamics simulationsBuckling instabilitybending021001 nanoscience & nanotechnologyZigzagPure bending0210 nano-technologyGraphene nanoribbonsgraphene nanoribbonsPhysical Review B
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Direct optical measurement of light coupling into planar waveguide by plasmonic nanoparticles

2012

Coupling of light into a thin layer of high refractive index material by plasmonic nanoparticles has been widely studied for application in photovoltaic devices, such as thin-film solar cells. In numerous studies this coupling has been investigated through measurement of e.g. quantum efficiency or photocurrent enhancement. Here we present a direct optical measurement of light coupling into a waveguide by plasmonic nanoparticles. We investigate the coupling efficiency into the guided modes within the waveguide by illuminating the surface of a sample, consisting of a glass slide coated with a high refractive index planar waveguide and plasmonic nanoparticles, while directly measuring the inte…

Materials scienceta221FOS: Physical sciencesPhysics::OpticsWaveguide (optics)Electric Power SuppliesSolar EnergyTransmittanceScattering RadiationComputer SimulationPlasmonic nanoparticlesta114business.industryHigh-refractive-index polymertechnology industry and agricultureMembranes ArtificialEquipment DesignSurface Plasmon ResonanceAtomic and Molecular Physics and OpticsCoupling (electronics)RefractometryComputer-Aided DesignNanoparticlesOptoelectronicsQuantum efficiencybusinessRefractive indexPhysics - OpticsOptics (physics.optics)Localized surface plasmonOptics Express
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Salkowski curves revisited: A family of curves with constant curvature and non-constant torsion

2009

In the paper [Salkowski, E., 1909. Zur Transformation von Raumkurven, Mathematische Annalen 66 (4), 517-557] published one century ago, a family of curves with constant curvature but non-constant torsion was defined. We characterize them as space curves with constant curvature and whose normal vector makes a constant angle with a fixed line. The relation between these curves and rational curves with double Pythagorean hodograph is studied. A method to construct closed curves, including knotted curves, of constant curvature and continuous torsion using pieces of Salkowski curves is outlined.

Mathematical analysisAerospace EngineeringDifferential geometry of curvesCurvatureComputer Graphics and Computer-Aided DesignConstant curvatureParametric surfaceModeling and SimulationFundamental theorem of curvesTorsion of a curveAutomotive EngineeringFamily of curvesConstant (mathematics)MathematicsComputer Aided Geometric Design
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On the population model with a sine function

2006

In the interval [0,1] function sr(x) = r sin πx behaves similar to logistic function h μ (x) = μx(1‐ x). We prove that for every r > there exists subset ? ⊂ [0,1] such that sr : ? → ? is a chaotic function. Since the logistic function is chaotic in another subset of [0,1] but both functions have similar graphs in [0,1] we conclude that it can lead to errors in practice. First Published Online: 14 Oct 2010

Mathematical analysisChaotic-Function (mathematics)logistic functionchaotic functionCombinatoricssine functionPopulation modelModeling and SimulationQA1-939Interval (graph theory)SineLogistic functionMathematicsAnalysisMathematicsMathematical Modelling and Analysis
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Explicit polynomial solutions of fourth order linear elliptic Partial Differential Equations for boundary based smooth surface generation

2011

We present an explicit polynomial solution method for surface generation. In this case the surface in question is characterized by some boundary configuration whereby the resulting surface conforms to a fourth order linear elliptic Partial Differential Equation, the Euler–Lagrange equation of a quadratic functional defined by a norm. In particular, the paper deals with surfaces generated as explicit Bézier polynomial solutions for the chosen Partial Differential Equation. To present the explicit solution methodologies adopted here we divide the Partial Differential Equations into two groups namely the orthogonal and the non-orthogonal cases. In order to demonstrate our methodology we discus…

Mathematical analysisFirst-order partial differential equationExplicit and implicit methodsAerospace EngineeringPartial differential equationExplicit polynomial solutionExponential integratorComputer Graphics and Computer-Aided DesignParabolic partial differential equationSurface generationPDE surfaceLinear differential equationElliptic partial differential equationModeling and SimulationAutomotive EngineeringSymbol of a differential operatorMathematicsComputer Aided Geometric Design
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DEGENERATE MATRIX METHOD FOR SOLVING NONLINEAR SYSTEMS OF DIFFERENTIAL EQUATIONS

1998

Degenerate matrix method for numerical solving nonlinear systems of ordinary differential equations is considered. The method is based on an application of special degenerate matrix and usual iteration procedure. The method, which is connected with an implicit Runge‐Kutta method, can be simply realized on computers. An estimation for the error of the method is given. First Published Online: 14 Oct 2010

Mathematical analysisMathematicsofComputing_NUMERICALANALYSISNumerical methods for ordinary differential equationsExplicit and implicit methods-Backward Euler methodModeling and SimulationCollocation methodQA1-939Crank–Nicolson methodDifferential algebraic equationMathematicsAnalysisMathematicsMatrix methodNumerical partial differential equationsMathematical Modelling and Analysis
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