Dynamical screening of an endohedral atom
Abstract
The present work is a generalisation of the dynamical screening factor presented in [1] to consider an atom located at an arbitrary position within the fullerene. A more elaborated investigation into the case where the atom is located at the centre is performed and compared with quantum mechanical calculations for dynamical screening factor of Ar@C [2] and Mg@C [3]. The and plasmons of the fullerene are accounted for in a modified screening factor to improve correspondence with the quantum calculations. The spatial dependence of the screening factor was explored with Ar@C and Ar@C and found to depend significantly on the radial distance of the atom from the centre of the fullerene. A spatial averaging of the screening factor is presented.
Cite
@article{arxiv.0811.1499,
title = {Dynamical screening of an endohedral atom},
author = {S Lo and A V Korol and A V Solov'yov},
journal= {arXiv preprint arXiv:0811.1499},
year = {2013}
}
Comments
18 pages, 7 figures