気液界面の非平衡輸送現象と反射分子のエネルギー適応係数

  • 徳永 敦士
    九州工業大学大学院工学府機械知能工学専攻
  • 長山 暁子
    九州工業大学大学院工学研究院機械知能工学研究系
  • 鶴田 隆治
    九州工業大学大学院工学研究院機械知能工学研究系

書誌事項

タイトル別名
  • Non-Equilibrium Transport Phenomena on Liquid Surface and Energy Accommodation Coefficients of Reflecting Molecules

抄録

Non-equilibrium molecular dynamics (NEMD) simulations have been carried out to obtain new evidence for the inverted temperature profile. We find that the inverted temperature profile occurs due to the excess energy transported by the reflecting molecules. A new definition of the accommodation coefficient for the reflecting molecule is proposed based on the comparison of the energy transferred by the reflecting molecule between the equilibrium and non-equilibrium conditions. The accommodation coefficient decreases with increasing the mass flux in the vicinity of the liquid surface and this is the reason for the inverted temperature profile. Also, a direct simulation of Monte Carlo (DSMC) method has been performed by applying the molecular boundary condition developed in the non-equilibrium molecular dynamics simulation. An inverted temperature profile is obtained without any contradiction to the second law because the reflecting molecules cannot accommodate to the equilibrium state.

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