Adsorption of imidazole on Au(111) surface: Dispersion corrected density functional study
(2016)
Journal Article
Izzaouihda, S., Mahjoubi, K., Abou El Makarim, H., Komiha, N., & Benoit, D. M. (2016). Adsorption of imidazole on Au(111) surface: Dispersion corrected density functional study. Applied Surface Science, 383, 233-239. https://doi.org/10.1016/j.apsusc.2016.04.144
We use density functional theory in the generalized gradient approximation to study the adsorption of imidazole on the Au(111) surface and account for dispersion effect using Grimme's empirical dispersion correction technique. Our results show that t... Read More about Adsorption of imidazole on Au(111) surface: Dispersion corrected density functional study.