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Modeling of fluid flows and heat transfer with interface effects, from molecular interaction to porous media

Abstract : The objectives of the thesis are to study the fluid transport and heat transfer in micro and nano-scale pores. Both experiments and simulations revealed evidence of an enhancement of flow-rate, originated from slip velocity at the solid boundary. On the other hand, the finite thermal resistance at the fluid-solid interface is responsible for the temperature difference between the two phases. These two interface phenomena can have a considerable impact on the permeability and thermal diffusivity of porous media constituted of micro and nano-pores. This contribution focuses on studying the following three issues. First, we examine the slip effects of liquids confined in graphene channel using Green Kubo formalism and Molecular Dynamics method. It is shown that when the solid surface is subject to mechanical uniaxial strain, the friction exhibits anisotropy due to the modification of the potential energy and the dynamics of the fluid molecules. The molecular shapes also play an important factor on the friction discrepancies between two principal directions. The quantification of both effects is addressed. Second, we investigate the rarefied gas regime. In this case, the velocity slip and temperature jump are governed by the collisions between the gas and the solid boundary. Those effects can be determined via the study of scattering kernel and its construction from MD simulation data. To this end, different methods based on statistical learning techniques have been proposed including the nonparametric (NP) kernel and Gaussian mixture (GM) kernel. Finally, the finite element method is used to compute the permeability and the thermal diffusivity of porous media under the influence of the interface effects
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Submitted on : Monday, April 1, 2019 - 11:02:10 AM
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  • HAL Id : tel-02086179, version 1



Meng Liao. Modeling of fluid flows and heat transfer with interface effects, from molecular interaction to porous media. Materials. Université Paris-Est, 2018. English. ⟨NNT : 2018PESC1054⟩. ⟨tel-02086179⟩



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