Physical adsorption of the Ba atom on Arn surfaces: spectroscopic and geometric properties
Marwa Slama,
Khaled Issa,
Houcine Ghalla
et al.
Abstract:Barium atoms cause several environmental and ecological dangers. Numerous techniques are employed to remove the Ba atom such as physisorption and solvation methods. In this work, we are interested in investigating and exploring the Ba atom's physical adsorption on argon surfaces. We have tested several optimizations and we have found that the first range of Ar atoms (n=1-12) presents more than 90 % of the energy interaction between Ba and the adsorbent surface. Therefore, we started by computing and analyzing… Show more
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