Computer simulations of waterโmetal inte
โ
K. Heinzinger; E. Spohr
๐
Article
๐
1989
๐
Elsevier Science
๐
English
โ 798 KB
The results of Molecular Dynamics simulations of a water lamella between platinum crystals and of water on a Pt(100) surface for different degrees of coverage are reported. The flexible BJH model of water is employed and the Pt-water interaction potential is derived from extended Hiickel molecular o