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    ARTICLE

    Molecule Dynamics Study on Heat Transfer at Gas-Nanoparticle Interface

    ZichunYang1, Gaohui Su1,2, Bin Chen1

    CMC-Computers, Materials & Continua, Vol.51, No.1, pp. 43-62, 2016, DOI:10.3970/cmc.2016.051.043

    Abstract The molecular dynamics (MD) simulations were used to understand the heat transfer process between the gas phase and the solid skeleton in the nanoporous silica aerogels. The amorphous silica nanoparticles were generated by the MD simulations and the energy accommodation coefficient (EAC) between the gases and the nanoparticles was calculated based on the results of the nonequilibrium molecular dynamics (NEMD) simulations. The apparent thermal conductivity (ATC) of the gases between the heat source and heat sink was also obtained. The effects of the temperature, the particle diameter and the molecule type on the EAC and the ATC were investigated. The… More >

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