Oxygen reduction reaction of FeN4 center embedded in graphene and carbon nanotube: Density functional calculations
A proton exchange membrane fuel cell is an energy device in which chemical energy is directly converted into electric energy through the oxygen reduction reaction (ORR). In this work, we have performed first-principles density functional theory calculations for the ORR of FeN4 center embeded in grap...
| Main Authors: | , , , , , , |
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| Format: | Article |
| Language: | English |
| Published: |
AIP Publishing LLC
2018-11-01
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| Series: | AIP Advances |
| Online Access: | http://dx.doi.org/10.1063/1.5053151 |