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cond-mat.mtrl-sci2019★ 9 cited
Magnetic, electrochemical and thermoelectric properties of
M. H. N. Assadi, S. Li, R. K. Zheng +2
We theoretically investigated the electronic, electrochemical and magnetic properties of Sb doped ( and ). dopants adopt +5 oxidation state…
cond-mat.mtrl-sci2012
Ab Initio Study of Phase Stability in Doped TiO2
Dorian A. H. Hanaor, Mohammed H. N. Assadi, Sean Li +2
Ab-initio density functional theory (DFT) calculations of the relative stability of anatase and rutile polymorphs of TiO2 were carried using all-electron atomic orbitals methods wi…