Search results for "THERMODYNAMICS"
showing 10 items of 2774 documents
First principles investigations of Pd-on-Au nanostructures for trichloroethene catalytic removal from groundwater
2010
Catalytic groundwater remediation from chlorinated organic solvents like trichloroethene (TCE) has been found to be more effective and sustainable than traditional non-destructive methods. Among the experimentally studied catalyst materials, Pd-decorated Au nanoparticles show the highest activity and selectivity combined with the best resistance towards poisoning by chemicals present in groundwater. In this study the thermochemistry and adsorption geometries of TCE and its hydrodechlorination products are investigated via density functional theory calculations. Various model systems for Pd-supported Au nanoparticles are addressed. The adsorption of TCE is endothermic on bare Au(111), almost…
Interpretation of the Co K-edge EXAFS in LaCoO3 using molecular dynamics simulations
2011
Abstract Temperature dependent (180–400 K) Co K-edge EXAFS spectra from perovskite-type rhombohedral ( R 3 ¯ c ) LaCoO 3 have been successfully interpreted using a combination of classical NVT molecular dynamics (MD) and ab initio multiple-scattering (MS) theory. The method allowed us to account entirely for thermal disorder and to interpret reliably the contribution from the coordination shells beyond the first one into the total EXAFS spectrum taking into account many-body effects. The best agreement between experimental and configuration-averaged EXAFS spectra was obtained for pure ionic La 3+ and partially ionic Co 1.35+ and O 1.45− charges indicating the mixed ionic-covalent character …
Numerical modelling of the linear friction welding process
2010
Linear friction welding (LFW) is a solid-state joining process applied to non-axisymmetric components. LFW involves joining of materials through the relative reciprocating motion of two components under an axial force. In such process the heat source is given by the frictional forces work decaying into heat determining a local softening of the material and proper bonding conditions due to both the temperature increase and the local pressure of the two edges to be welded. In the present work the authors present a numerical model of the linear friction welding process of AISI 1045 parts. The numerical model allowed to highlight the process mechanics and the physical conditions which must be r…
Multiscale analysis of information dynamics for linear multivariate processes.
2016
In the study of complex physical and physiological systems represented by multivariate time series, an issue of great interest is the description of the system dynamics over a range of different temporal scales. While information-theoretic approaches to the multiscale analysis of complex dynamics are being increasingly used, the theoretical properties of the applied measures are poorly understood. This study introduces for the first time a framework for the analytical computation of information dynamics for linear multivariate stochastic processes explored at different time scales. After showing that the multiscale processing of a vector autoregressive (VAR) process introduces a moving aver…
Directed Assembly of Soft Colloids through Rapid Solvent Exchange
2015
We studied the directed assembly of soft nanoparticles through rapid micromixing of polymers in solution with a nonsolvent. Both experiments and computer simulations were performed to elucidate the underlying physics and to investigate the role of various process parameters. In particular, we discovered that no external stabilizing agents or charged end groups are required to keep the colloids separated from each other when water is used as the nonsolvent. Furthermore, the size of the nanoparticles can be reliably tuned through the mixing rate and the ratio between polymer solution and nonsolvent. Our results demonstrate that this mechanism is highly promising for the mass fabrication of un…
Mass transfer in nonisothermal ferrocolloids under the effect of a magnetic field
1999
Abstract The paper presents a review of newest experimental results on particle thermal diffusion in hydrocarbon based ferrofluids. The measurements are performed using a vertical thermal diffusion column, the Soret coefficient is evaluated from particle separation curves employing a simple column theory which accounts for thermal convection in the vertical channel forced by a concentration buoyancy force arising during the thermophoretic transfer of heavy particles. High positive values of the Soret coefficient of lyophilized Fe 3 O 4 and Mn x Zn 1− x Fe 2 O 4 particles in surfacted tetradecane based colloids are measured. Experiments confirm the theoretically predicted anisotropy of parti…
Non-isothermal mass transfer of ferrocolloids through porous membrane
2011
Abstract The present paper deals with transport properties of ferrofluid nanoparticles in non-isothermal capillary-porous layer. Experiment establishes that the temperature difference, which is applied across the layer, induces a thermoosmotic pressure gradient directed toward increasing temperature. The measurement results are interpreted in a frame of phenomenology of linear irreversible thermodynamics. The transport coefficients are evaluated comparing the measured separation curves with approximate solution of the corresponding mass transfer problem.
Transport properties of an ionic magnetic colloid: experimental study of increasing the ionic strength
2002
Abstract The phase separation of an ionic magnetic colloid in zero magnetic field by increasing the ionic strength is well known [Universite Paris VI, France, 1987; J. Colloid Interface Sci. 132 (1989) 1]. The present work deals with investigation of an ionic ferrofluid by increasing the ionic strength in the range of 0–0.14 mol/l, being safely below the threshold value at which the effect of phase separation occurs. By the optical grid setup [Fourth International conference PAMIR, France, 2000], the main transport properties of a ferrofluid, i.e. translational mass diffusion and thermal diffusion (Soret) coefficients, are measured. The obtained results show a strong dependence of mass diff…
Characterization of postural control impairment in women with fibromyalgia
2018
[EN] The main goal of this cross-sectional study was to detect whether women with fibromyalgia syndrome (FMS) have altered postural control and to study the sensory contribution to postural control. We also explored the possibility that self-induced anxiety and lower limb strength may be related to postural control. For this purpose, 129 women within an age range of 40 to 70 years were enrolled. Eighty of the enrolled women had FMS. Postural control variables, such as Ellipse, Root mean square (RMS) and Sample entropy (SampEn), in both directions (i.e. mediolateral and anteroposterior), were calculated under five different conditions. A force plate was used to register the center of pressur…
Valorisation de machines frigorifiques a adsorption sur zeolithes
1991
Abstract The regeneration stage using intermittent thermodynamical cycles based on zeolite adsorption (zeolite 13X-H2O) has been studied. This point is of particular interest for understanding of systems of energy storage and cooling. This paper examines the use of microwave energy sources for analysing the regeneration problem. The method proposed allows a considerable decrease in the regeneration time without an increase of the temperature of the material. The energy yields are high and the adsorption-desorption time cycles are short if the microwave field is well tuned. This last is a function of time and of the filling coefficient. The results obtained using microwave irradiation are co…