Identification of Active Sites of Pure and Nitrogen-Doped Carbon Materials for Oxygen Reduction Reaction Using Constant-Potential Calculations
Author(s) -
Zhiyao Duan,
Graeme Henkelman
Publication year - 2020
Publication title -
the journal of physical chemistry c
Language(s) - English
Resource type - Journals
SCImago Journal Rank - 1.401
H-Index - 289
eISSN - 1932-7455
pISSN - 1932-7447
DOI - 10.1021/acs.jpcc.0c03951
Subject(s) - carbon fibers , catalysis , doping , electrochemistry , graphite , zigzag , nitrogen , chemistry , materials science , active site , inorganic chemistry , organic chemistry , electrode , composite material , optoelectronics , geometry , mathematics , composite number
Nitrogen-doped carbon materials are promising metal-free catalysts for the electrochemical oxygen reduction reaction (ORR). A better theoretical understanding on the nature of the active site(s) wo...
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