PZC shifts with metal-site density better predict density-dependent ORR activity and selectivity in Fe-N-C and Co-N-C than spin state does, via explicit-solvent simulations and a pH-field microkinetic model.
Why Do Weak-Binding M–N–C Single-Atom Catalysts Possess Anomalously High Oxygen Reduction Activity? Journal of the American Chemical Society 2025, 147 (7), 6076-6086
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Spin State versus Potential of Zero Charge as Predictors of Density-Dependent Oxygen Reduction in M-N-C Electrocatalysts
PZC shifts with metal-site density better predict density-dependent ORR activity and selectivity in Fe-N-C and Co-N-C than spin state does, via explicit-solvent simulations and a pH-field microkinetic model.