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Revisiting the activity origin of the PtAu<sub>24</sub>(SR)<sub>18</sub> nanocluster for enhanced electrocatalytic hydrogen evolution by combining first-principles simulations with the experimental <i>in situ</i> FTIR technique

Fang Sun, Lubing Qin, Zhenghua Tang, Qing Tang

2024Chemical Science26 citationsDOIOpen Access PDF

Abstract

We combined first-principles calculations and in situ FTIR characterizations to reveal that the enhanced HER activity of the PtAu 24 (SR) 18 nanocluster is contributed not only by the central Pt atom but also by the exposed bridged Au sites.

Topics & Concepts

In situHydrogenElectrocatalystMaterials scienceNanotechnologyChemistryElectrodePhysical chemistryElectrochemistryOrganic chemistryNanocluster Synthesis and ApplicationsElectrocatalysts for Energy ConversionAdvanced Nanomaterials in Catalysis
Revisiting the activity origin of the PtAu<sub>24</sub>(SR)<sub>18</sub> nanocluster for enhanced electrocatalytic hydrogen evolution by combining first-principles simulations with the experimental <i>in situ</i> FTIR technique | Litcius