Snyder M A, Vlachos D G
Department of Chemical Engineering, University of Delaware, Newark, Delaware 19716-3110, USA.
Phys Rev E Stat Nonlin Soft Matter Phys. 2005 Jun;71(6 Pt 1):060201. doi: 10.1103/PhysRevE.71.060201. Epub 2005 Jun 22.
Phase behavior in nanostructured thin films under a gradient in chemical potential is studied via kinetic Monte Carlo simulation. Switching between saturated, partially saturated, and unsaturated states drives precipitous changes in permeation. This phenomenon could render nanostructured thin films as molecular valves, where adsorbate-adsorbate forces actuate the flow of molecules.
通过动力学蒙特卡罗模拟研究了在化学势梯度下纳米结构薄膜中的相行为。在饱和、部分饱和和不饱和状态之间切换会驱动渗透率的急剧变化。这种现象可使纳米结构薄膜成为分子阀,其中吸附质-吸附质作用力驱动分子流动。