Monolayer organization modelling using molecular dynamics

Citation
S. Rovillard et al., Monolayer organization modelling using molecular dynamics, LANGMUIR, 15(8), 1999, pp. 2749-2754
Citations number
10
Categorie Soggetti
Physical Chemistry/Chemical Physics
Journal title
LANGMUIR
ISSN journal
07437463 → ACNP
Volume
15
Issue
8
Year of publication
1999
Pages
2749 - 2754
Database
ISI
SICI code
0743-7463(19990413)15:8<2749:MOMUMD>2.0.ZU;2-F
Abstract
Many experiments have highlighted the existence of an unexpected long-range attractive force between two hydrophilic or hydrophobic monolayers, immers ed in water or in nonaqueous solvents. The origin of this attraction has no t been discovered yet. A mechanism responsible for these forces may be an i nteraction between ordered domains of the two close monolayers. The occurre nce and characteristics of such domains are related to the nature of their constituting molecules and also their structural organization. We present h ere a molecular analysis, via molecular dynamics simulations, of ordered do mains within a monolayer. We investigate the dependence between the charact eristics of the domains and both the length of the molecules and the layer density.