Orientation of rod molecules in selective slits: a density functional theory
โ Scribed by Xu, Xiaofei; Cao, Dapeng; Wang, Wenchuan
- Book ID
- 121758725
- Publisher
- Institute of Physics
- Year
- 2008
- Tongue
- English
- Weight
- 940 KB
- Volume
- 20
- Category
- Article
- ISSN
- 0953-8984
No coin nor oath required. For personal study only.
๐ SIMILAR VOLUMES
Density functional theory is applied to a Lennard-Jones fluid near a single hard wall and in a slit formed by two walls. We use some simplified versions of the Weeks-Chandler-Andersen (WCA) and the Barker-Henderson (BH) theories. Only the most crude mean field version of the WCA theory, in which the
Adsorption of associating particles interacting via the Lennard-Jones potential in slit-like pores is studied using the density functional theory. A model of association with one site per particle is considered. Capillary phase diagrams for three values of the association energy are evaluated. We sh