A DFT+U Investigation on Methylamine Decomposition Catalyzed by Pt 4 Cluster Supported on Oxygen Defective Rutile (110) TiO 2
Sign Up to like & getrecommendations! Published in 2017 at "Chemical Research in Chinese Universities"
DOI: 10.1007/s40242-017-6489-z
Abstract: The adsorption and decomposition mechanisms of methylamine catalyzed by Pt4 cluster supported on rutile(110) titania[namely, Pt4/TiO2-R(110)] were investigated via density functional theory slab calculations with Hubbard corrections(DFT+U). The adsorption energies under the most stable configuration… read more here.
Keywords: rutile 110; methylamine decomposition; decomposition; cluster supported ... See more keywords