| Article ID | Journal | Published Year | Pages | File Type |
|---|---|---|---|---|
| 5422934 | Surface Science | 2011 | 7 Pages |
Abstract
⺠Cyclopentene interaction with InP(001) is investigated by density functional theory. ⺠A simple approach for evaluating the surface strain is suggested. ⺠A linear relation between bond (strain) and adsorption energies is established. ⺠Charge density associated to the HOMO is more disperse for higher bond energies.
Related Topics
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Physical and Theoretical Chemistry
Authors
P.P. Favero, A.C. Ferraz, W.G. Schmidt, R. Miotto,