Role of atomicity in the oxygen reduction reaction activity of platinum sub nanometer clusters: A global optimization study.

Nair, Akhil S; Anoop, Anakuthil; Ahuja, Rajeev; Pathak, Biswarup.

Nair AS; Department of Chemistry, Indian Institute of Technology Indore, Indore, Madhya Pradesh, India.
Anoop A; Department of Chemistry, Indian Institute of Technology Kharagpur, Kharagpur, West Bengal, India.
Ahuja R; Condensed Matter Theory Group, Department of Physics and Astronomy, Uppsala University, Uppsala, Sweden.
Pathak B; Department of Physics, Indian Institute of Technology Ropar, Ropar, Punjab, India.

J Comput Chem ; 42(27): 1944-1958, 2021 Oct 15.

Article en En | MEDLINE | ID: mdl-34309891