Helium in polygonal nanopores at zero temperature: Density functional theory calculations


Autoria(s): Hernando, Alberto; Hernández, E. Susana; Mayol Sánchez, Ricardo; Pi Pericay, Martí
Contribuinte(s)

Universitat de Barcelona

Data(s)

04/05/2010

Resumo

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.

Identificador

http://hdl.handle.net/2445/10585

Idioma(s)

eng

Publicador

The American Physical Society

Direitos

(c) The American Physical Society, 2008

info:eu-repo/semantics/openAccess

Palavras-Chave #Teoria del funcional de densitat #Adsorció #Heli #Nanoestructures #Density functional theory #Adsorption #Helium #Nanostructures
Tipo

info:eu-repo/semantics/article