| Article ID | Journal | Published Year | Pages | File Type |
|---|---|---|---|---|
| 1562469 | Computational Materials Science | 2011 | 7 Pages |
Abstract
⺠Adsorption energetics within a periodic formalism. ⺠Nearest and next-nearest neighboring interacting molecules model for adsorption. ⺠Extrapolation of the binding, the interaction and the distortion energies in the limit of an isolated adsorbed molecule.
Keywords
Related Topics
Physical Sciences and Engineering
Engineering
Computational Mechanics
Authors
J. Scaranto, G. Mallia, N.M. Harrison,