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Bifunctional Oxygen Reduction/Evolution Reaction Activity of Transition Metal-Doped T-C3N2 Monolayer: A Density Functional Theory Study Assisted by Machine Learning

ACS APPLIED NANO MATERIALS(2024)

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Key words
transition metal-doped T-C3N2,bifunctional OER/ORR electrocatalyst,machine learning,density functional theory,biaxial strain
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