Unveiling the electrocatalytic potential of main-group metal-doped blue phosphorene for oxygen and hydrogen evolution reaction through computational study

Hao Hu, Yang-Chun Yong, Peng Zhang, Wei Tang,Beibei Xiao,Jian-Li Mi

Journal of Materials Chemistry A(2024)

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摘要
A systematic investigation using first principles calculations has explored the electrocatalytic potential of eleven main-group metal-doped blue phosphorene (M-BPs) for the oxygen evolution reaction (OER) and hydrogen evolution reaction (HER)....
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