Molecular Simulation on Transport Properties of Confined Water
摘要
The diffusivity and viscosity of water confined in micropores were studied by molecular dynamics simulations. The effects of pore width and density were analyzed at pore widths from 0.9 to 2.6nm. The diffusivity in micropores is lower than that of the bulk, and it decreases as pore width decreases and as density increases. But the viscosity in micropores is much larger than that of the bulk, and it increases as pore width decreases and as density increases. The diffusivity in channel parallel direction is obviously larger than that in channel perpendicular directions.
引用本文（GB/T 7714）
YingChunLIU, GuoZhenXIAO, QiWang. Molecular Simulation on Transport Properties of Confined Water[J]. 中国化学快报：英文版, 2004.
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