Elucidating the oxygen reduction reaction kinetics on defect engineered nanocarbon electrocatalyst: interplay between the N-dopant and defect sites

Autor: Sakshi Bhardwaj, Samadhan Kapse, Soirik Dan, Ranjit Thapa, Ramendra Sundar Dey
Rok vydání: 2023
Předmět:
Zdroj: Journal of Materials Chemistry A.
ISSN: 2050-7496
2050-7488
Popis: For oxygen reduction reaction (ORR), the active sites of a defective N-doped graphene are predicted by a quantum mechanics/machine learning approach; the synthesized catalyst shows exemplary ORR activity that was further confirmed by a DFT study.
Databáze: OpenAIRE