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Published in 2018 at "Theoretical Chemistry Accounts"
DOI: 10.1007/s00214-018-2211-6
Abstract: Abstract Adsorbed Ni in a clean rutile $$\hbox {TiO}_{2}$$TiO2 (110) surface has been investigated by computing the electronic band structure and the optical linear response properties within the density functional theory. We have determined the…
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Keywords:
hbox ni55;
hbox tio;
tio tio2;
hbox ... See more keywords