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Published in 2020 at "International Journal of Hydrogen Energy"
DOI: 10.1016/j.ijhydene.2019.10.205
Abstract: Abstract The density functional theory (DFT) calculations were performed to investigate the stability of the S-doped Fe–N2G electrocatalysts, as well as ORR mechanism and activity. The most stable configuration is the Fe–N2S1G because of forming…
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Keywords:
reaction sulfur;
mechanisms insight;
insight oxygen;
sulfur doped ... See more keywords