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cond-mat.mtrl-sci2013
Dependence of Dopant Geometry on Na Concentration in
M. H. N. Assadi, H. Katayama-Yoshida
In this work, we investigated the behaviour of Sb dopants in for Na concentrations of and by density functional theory. We chose $Na_{x}CoO…
cond-mat.mtrl-sci2013★ 69 cited
Theoretical study on copper's energetics and magnetism in TiO2 polymorphs
M. Hussein. N. Assadi, Dorian A. H. Hanaor
We carried out density functional theory calculations to model the electronic structure and the magnetic interactions in copper doped anatase and rutile titanium dioxide in order t…