An ab initio study of the adsorption of Eu3+, Pu3+, Am3+, and Cm3+ hydroxide complexes on hematite (001) surface: Role of magnetism on adsorption
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DOI: 10.1016/j.susc.2017.06.007
Abstract: Abstract Inner-sphere hydroxide complexes of Eu3+, Pu3+, Am3+, and Cm3+ adsorbed to antiferromagnetic and ferromagnetic hematite (001) surfaces were modeled by using DFT (GGA + U) calculations in order to compare the electronic properties, atomic structures, and… read more here.
Keywords: pu3 am3; adsorption; hematite 001; surface ... See more keywords