In-situ synthesis of Pd nanocrystals with exposed surface-active facets on g-C₃N₄ for photocatalytic hydrogen generation

Engineering surface-active facets of metal cocatalysts is one of the most widely explored strategies to develop advanced photocatalysts and promote photocatalytic solar energy conversion. Here, the surface-active facets of Pd nanocrystals in Pd/g-C₃N₄ photocatalyst was related to the injection flow rate of PdCl₂. When PdCl₂ was injected at a low flow rate of 7.5 mL/h (7.5-Pd/g-C₃N₄), the Pd nanocrystals were uniformly dispersed onto the g-C₃N₄ with exposed low-index {100} and {111} surface-active facets. However, increasing the injection flow rate to 150 mL/h (150-Pd/g-C₃N₄) formed Pd nanocrystals where only the {100} surface-active facet was exposed. Under visible light irradiation, the 7.5-Pd/g-C₃N₄ nanocomposite exhibited excellent water splitting activity for hydrogen production (7.61 mmol g⁻¹ h⁻¹), which was significantly better than with the 150-Pd/g-C₃N₄ nanocomposite (3.3 mmol g⁻¹ h⁻¹). Theoretical calculations and experimental results confirm the importance of the {111} surface-active facets in the 7.5-Pd/g-C₃N₄ nanocomposite for promoting photocatalytic activity.