Interaction of nitric oxide with the (1 0 0) surface of cobalt spinel nanocubes – A comprehensive DFT, atomistic thermodynamic, IR and TPD account
Sign Up to like & getrecommendations! Published in 2020 at "Applied Surface Science"
DOI: 10.1016/j.apsusc.2020.145835
Abstract: Abstract Periodic spin-unrestricted DFT + U/PW91 calculations, atomistic thermodynamic modeling and IR and TPD measurements were used to study structure and stability of various NO adspecies on the (1 0 0) surface of Co3O4 nanocubes. A large variety of… read more here.
Keywords: atomistic thermodynamic; surface; cot; tpd ... See more keywords