First-principles study on the atomistic corrosion processes of iron - Chew, Khian-Hooi; Kuwahara, Riichi; Ohno, Kaoru (Physical chemistry chemical physics : PCCP, 2018)
Keywords: Activation energy; Corrosion; Corrosion mechanisms; Corrosion tests; Density functional theory; Dimers; First principles; Hematite; Iron oxides; Materials science; Oxygen reduction reactions; Water chemistry; Water splitting