Simfukwe, Joseph; Mapasha, Refilwe Edwin; Artur Braun; Diale, M. (Mmantsae Moche)
(Cambridge University Press, 2018-02)
Density Functional Theory (DFT) calculations study of Cu doped {0001} and {01-12}
surfaces of hematite for enhanced water splitting have been carried out. The doping was
restricted to planes in the vicinity of the surface, ...