Search results for "THERMODYNAMICS"

showing 10 items of 2774 documents

An alternative space-time meshless method for solving transient heat transfer problems with high discontinuous moving sources

2016

International audience; The aim of this work is the development of a space-time diffuse approximation meshless method (DAM) to solve heat equations containing discontinuous sources. This work is devoted to transient heat transfer problems with static and moving heat sources applied on a metallic plate and whose power presents temporal discontinuities. The space-time DAM using classical weight function is convenient for continuous transient heat transfer. Nevertheless, for problems including discontinuities, some spurious oscillations for the temperature field occur. A new weight function, respecting the principle of causality, is used to eradicate the physically unexpected oscillations.

[ SPI.MECA.GEME ] Engineering Sciences [physics]/Mechanics [physics.med-ph]/Mechanical engineering [physics.class-ph]Work (thermodynamics)Weight functionField (physics)finite element method02 engineering and technologyClassification of discontinuitieselasto-dynamic problems01 natural sciences[SPI]Engineering Sciences [physics]0203 mechanical engineering[ SPI ] Engineering Sciences [physics]free galerkin methodrefinement0101 mathematicsconvectionMathematicsNumerical AnalysisSpace timeMechanicsCondensed Matter Physics[ SPI.MECA.THER ] Engineering Sciences [physics]/Mechanics [physics.med-ph]/Thermics [physics.class-ph][SPI.MECA.GEME]Engineering Sciences [physics]/Mechanics [physics.med-ph]/Mechanical engineering [physics.class-ph]Computer Science ApplicationsPower (physics)010101 applied mathematics020303 mechanical engineering & transportsClassical mechanicsMechanics of MaterialsModeling and Simulation[SPI.MECA.THER]Engineering Sciences [physics]/Mechanics [physics.med-ph]/Thermics [physics.class-ph]Heat equationDevelopment (differential geometry)
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Towards Iron(II) Complexes with Octahedral Geometry: Synthesis, Structure and Photophysical Properties

2020

The control of ligand-field splitting in iron (II) complexes is critical to slow down the metal-to-ligand charge transfer (MLCT)-excited states deactivation pathways. The gap between the metal-centered states is maximal when the coordination sphere of the complex approaches an ideal octahedral geometry. Two new iron(II) complexes (C1 and C2), prepared from pyridylNHC and pyridylquinoline type ligands, respectively, have a near-perfect octahedral coordination of the metal. The photophysics of the complexes have been further investigated by means of ultrafast spectroscopy and TD-DFT modeling. For C1, it is shown that&mdash

[CHIM.INOR] Chemical Sciences/Inorganic chemistryLigand field theoryCoordination sphereMaterials scienceIronPharmaceutical Scienceexcited states dynamics[CHIM.INOR]Chemical Sciences/Inorganic chemistryCrystallography X-RayLigands010402 general chemistry01 natural sciencesArticletime-resolved spectroscopyAnalytical Chemistrylcsh:QD241-441MetalX-Ray Diffractionlcsh:Organic chemistryDrug DiscoveryOctahedral molecular geometry[CHIM.CRIS]Chemical Sciences/Cristallographyiron (II) complexes[CHIM.COOR]Chemical Sciences/Coordination chemistryFerrous Compounds[CHIM.CRIS] Chemical Sciences/CristallographyPhysical and Theoretical Chemistryoctahedral geometrydensity functional theoryComputingMilieux_MISCELLANEOUSMolecular Structure010405 organic chemistryLigandOrganic Chemistry[CHIM.COOR] Chemical Sciences/Coordination chemistry0104 chemical sciences3. Good healthCrystallographyOctahedron[CHIM.OTHE] Chemical Sciences/OtherChemistry (miscellaneous)Excited statevisual_artvisual_art.visual_art_mediumThermodynamicsMolecular MedicineDensity functional theory[CHIM.OTHE]Chemical Sciences/Other
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Coupled Modelling of ZrO 2 /α-Zr(O) Layers Growth under Thermal and Mechanical Gradients

2019

The oxidation process of a nuclear reactor fuel rod clad made of zirconium is simulated. It is assumed that the oxygen is transported by anionic diffusion in the zirconia layer (ZrO2). Part of this oxygen reacts at the interface between the zirconia layer and the metal, while the rest diffuses in the oxygen-enriched metal volume (α-Zr(O)) to the core of the metal by an interstitial mechanism. The model is based on the thermodynamics of irreversible processes and takes into account the influence of driving forces on the oxygen migration in the metal such as the oxygen concentration gradient, the temperature gradient [1] and the mechanical stress gradient [2]. The growth of both ZrO2 and α-Zr…

[CHIM.INOR] Chemical Sciences/Inorganic chemistry[CHIM.MATE] Chemical Sciences/Material chemistryZirconium oxidationthermal-mechanical-diffusion coupled modellingnon-equilibrium thermodynamics
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An empirical method to determine the free surface energy of solids at different deformations and temperatures regimes : An application to Al.

2005

Abstract We have performed molecular dynamics (MD) simulations using the three low index surfaces of Al to determine the variation of the surface energy as a function of deformation and temperature. We have also developed an empirical formulation for the surface free energy as a function of deformation. The observed difference between the numerical and analytical results has led us to divide the deformation into a mechanical and a thermal contribution. From this observation, we have obtained an expression for the surface free energy placing the temperature dependence on the bulk and surface elastic constants. Our simulations permitted us to analyze the multilayer relaxation for the particul…

[CHIM.MATE] Chemical Sciences/Material chemistryChemistrySurface stressaluminiumchemistry.chemical_elementThermodynamicsSurfaces and Interfacessurface relaxationCondensed Matter PhysicsSpecific surface energySurface energymolecular dynamicsSurfaces Coatings and FilmsMolecular dynamicsAluminiumsurface energyFree surface[ CHIM.MATE ] Chemical Sciences/Material chemistryThermalMaterials ChemistrySurface structurePhysical chemistry
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Vibrating temporal soliton pairs

2007

The study of temporal multisoliton complexes in dissipative systems is of potential interest for the development of new schemes of optical data transport and processing. In the present work, we thus consider pulsations of a soliton pair that consist mainly in the oscillations of the temporal separation and phase relationship between the two pulses, so that the relative motion of the two bound solitons resembles a vibrational motion.

[PHYS.PHYS.PHYS-OPTICS] Physics [physics]/Physics [physics]/Optics [physics.optics]Physics[PHYS.PHYS.PHYS-OPTICS]Physics [physics]/Physics [physics]/Optics [physics.optics]3D optical data storageWork (thermodynamics)[ PHYS.PHYS.PHYS-OPTICS ] Physics [physics]/Physics [physics]/Optics [physics.optics]Computer simulation01 natural sciences010309 opticsVibrationDissipative solitonNonlinear Sciences::Exactly Solvable and Integrable SystemsClassical mechanicsMode-locking0103 physical sciencesDissipative systemSoliton010306 general physicsNonlinear Sciences::Pattern Formation and SolitonsComputingMilieux_MISCELLANEOUS
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Low-cost viscometer based on energy dissipation in viscous liquids

2001

We describe a new type of low-cost easy-to-use viscometer based on the temperature elevation in a liquid under shear flow. After calibration, this instrument can be used to measure the apparent steady state viscosity for both Newtonian and non-Newtonian liquids with no yield stress. We compute the rise in temperature due to viscous dissipation in a Couette cell and compare it to experimental results for different fluids. We show that the variation of the temperature with shear rate can be used to characterize the rheological behaviour of viscous fluids and to evaluate their viscosity in a large domain, from typically a few cP up to more than 10 P, with an accuracy of about ±5%. In contrast …

[PHYS]Physics [physics]Materials science[ PHYS ] Physics [physics]Applied MathematicsThermodynamicsViscometer02 engineering and technologyViscous liquidApparent viscosity021001 nanoscience & nanotechnology01 natural sciences[PHYS] Physics [physics]Condensed Matter::Soft Condensed MatterPhysics::Fluid DynamicsShear rateViscosityRheology0103 physical sciencesNewtonian fluid010306 general physics0210 nano-technologyShear flowInstrumentationEngineering (miscellaneous)ComputingMilieux_MISCELLANEOUS
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Phase partitioning of aerosol particles in clouds at Kleiner Feldberg

1994

The partitioning of aerosol particles between cloud droplets and interstitial air by number and volume was determined both in terms of an integral value and as a function of size for clouds on Mt. Kleiner Feldberg (825 m asl), in the Taunus Mountains north-west of Frankfurt am Main, Germany. Differences in the integral values and the size dependent partitioning between two periods during the campaign were observed. Higher number and volume concentrations of aerosol particles in the accumulation mode were observed during Period II compared to Period I. In Period I on average 87 ± 11% (±one standard deviation) and 73 ± 7% of the accumulation mode volume and number were incorporated into cloud…

[SDU.OCEAN]Sciences of the Universe [physics]/Ocean AtmosphereAtmospheric Science010504 meteorology & atmospheric sciencesChemistrySize dependentNucleation010501 environmental sciencesEntrainment (meteorology)Atmospheric sciences01 natural sciencesStandard deviationAerosolVolume (thermodynamics)13. Climate actionPhase (matter)Environmental ChemistryScavengingComputingMilieux_MISCELLANEOUS0105 earth and related environmental sciencesJournal of Atmospheric Chemistry
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The role of VOC oxidation products in continental new particle formation

2008

Abstract. Aerosol physical and chemical properties and trace gas concentrations were measured during the QUEST field campaign in March–April, 2003, in Hyytiälä, Finland. Our aim was to understand the role of oxidation products of VOC's such as mono- and sesquiterpenes in atmospheric nucleation events. Particle chemical compositions were measured using the Aerodyne Aerosol Mass Spectrometer, and chemical compositions of aerosol samples collected with low-pressure impactors and a high volume sampler were analysed using a number of techniques. The results indicate that during and after new particle formation, all particles larger than 50 nm in diameter contained similar organic substances that…

[SDU.OCEAN]Sciences of the Universe [physics]/Ocean AtmosphereAtmospheric ScienceRange (particle radiation)010504 meteorology & atmospheric sciencesChemistry[SDU.OCEAN] Sciences of the Universe [physics]/Ocean AtmosphereNucleationAnalytical chemistry010501 environmental sciencesMass spectrometry01 natural scienceslcsh:QC1-999Trace gasAerosollcsh:Chemistrylcsh:QD1-999Volume (thermodynamics)13. Climate actionDifferential mobility analyzerParticle/dk/atira/pure/subjectarea/asjc/1900/1902lcsh:Physics0105 earth and related environmental sciences
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Ultrathin Tropical Tropopause Clouds (UTTCs): II. Stabilization mechanisms

2003

Abstract. Mechanisms by which subvisible cirrus clouds (SVCs) might contribute to dehydration close to the tropical tropopause are not well understood. Recently Ultrathin Tropical Tropopause Clouds (UTTCs) with optical depths around 10-4 have been detected in the western Indian ocean. These clouds cover thousands of square kilometers as 200-300 m thick distinct and homogeneous layer just below the tropical tropopause. In their condensed phase UTTCs contain only 1-5% of the total water, and essentially no nitric acid. A new cloud stabilization mechanism is required to explain this small fraction of the condensed water content in the clouds and their small vertical thickness. This work sugges…

[SDU.OCEAN]Sciences of the Universe [physics]/Ocean AtmosphereAtmospheric ScienceSupersaturationWork (thermodynamics)010504 meteorology & atmospheric sciencesChemistry[SDU.OCEAN] Sciences of the Universe [physics]/Ocean AtmosphereEvaporationAtmospheric sciences010502 geochemistry & geophysics01 natural scienceslcsh:QC1-999lcsh:Chemistrylcsh:QD1-999Liquid water content13. Climate actionPhase (matter)Tropical tropopauseddc:550UpwellingCirruslcsh:Physics0105 earth and related environmental sciencesUTTCsultrathin tropical tropospause
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Rapid odorant release in mammalian odour binding proteins facilitates their temporal coupling to odorant signals.

2010

 ; We have measured the effect of rat odorant-binding protein 1 on the rates of ligand uptake and liquid-to-air transfer rates with a set of defined odorous compounds. Comparison of observed rate constants (k(obs)) with data simulated over a wide range of different kinetic and thermodynamic regimes shows that the data do not agree with the previously held view of a slow off-rate regime (k(off) <0.0004 s(-1)). We propose that a rapid koff would be a necessary requirement for such a system, since slow odorant-release rates would result in significant decorrelation between the olfactory world and odour perception. (c) 2010 Elsevier Ltd. All rights reserved.

[SDV.BIO]Life Sciences [q-bio]/BiotechnologyKineticsAnalytical chemistryOlfactionAcetatesCalorimetryIn Vitro Techniques[ SDV.BA ] Life Sciences [q-bio]/Animal biologyLigandsReceptors OdorantDNA-binding proteinMass Spectrometry03 medical and health sciences0302 clinical medicineReaction rate constantStructural BiologyODORANT-BINDING PROTEINSAnimals[INFO.INFO-BT]Computer Science [cs]/BiotechnologyMolecular Biology030304 developmental biology0303 health sciencesChemistryTemporal couplingLigand[SDV.BA]Life Sciences [q-bio]/Animal biology[ SDV.BIO ] Life Sciences [q-bio]/BiotechnologyRecombinant ProteinsRatsSmellKineticsOdorantsBiophysicsOLFACTIONThermodynamics[ INFO.INFO-BT ] Computer Science [cs]/Biotechnology030217 neurology & neurosurgerypsychological phenomena and processesSignal TransductionJournal of molecular biology
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