Electronic-state-driven adsorption of O2 on a nanocrystalline TiO2 under ‘dark’ and UV-irradiation conditions: Ab initio study
Sign Up to like & getrecommendations! Published in 2018 at "Chemical Physics Letters"
DOI: 10.1016/j.cplett.2018.03.012
Abstract: Abstract DFT study on O2 adsorption on a nanocrystalline titania is presented for the first time. The dioxide’s nanoparticle is modeled via the nanocluster Ti8O16. According to the calculations, O2 physisorbs on the nanocluster Ti8O16… read more here.
Keywords: adsorption; adsorption nanocrystalline; electronic state; study ... See more keywords