Stability of oxygen point defects in UO 2 by first-principles DFT + U calculations: Occupation matrix control and Jahn-Teller distortion

By B. Dorado, G. Jomard, M. Freyss, M. Bertolus. 2010

171 citations recorded by the source corpus.

Subfields: Geophysics, Inorganic Chemistry, Materials Chemistry

View Paper: https://www.semanticscholar.org/paper/a1b15a620af157fedd12e464275d1be083595066