Helium In Polygonal Nanopores At Zero Temperature: Density Functional Theory Calculations

Physical Review B(2008)

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摘要
We investigate adsorption of helium in nanoscopic polygonal pores at zero temperature using a finite-range density functional theory. The adsorption potential is computed by means of a technique denoted as the elementary source method. We analyze a rhombic pore with Cs walls, where we show the existence of multiple interfacial configurations at some linear densities, which correspond to metastable states. Shape transitions and hysterectic loops appear in patterns which are richer and more complex than in a cylindrical tube with the same transverse area.
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关键词
polygonal nanopores,density,functional theory calculations
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