Tunable Ferroelectric Polarization in BaTiO3 Coupled with Zn0.5Cd0.5S Quantum Dots for Efficient Solar‐Driven Hydrogen Evolution

Advanced Energy Materials, EarlyView.

Feb 24, 2025 - 10:52
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Tunable Ferroelectric Polarization in BaTiO3 Coupled with Zn0.5Cd0.5S Quantum Dots for Efficient Solar-Driven Hydrogen Evolution

A synergistic approach by combining the tunable built-in electric field of ferroelectric BaTiO3 (BTO) with a Z-scheme heterojunction design in Zn0.5Cd0.5S quantum dots (ZCS QDs). The spontaneous polarization of BTO creates a strong and adjustable electric field that promotes carrier separation and enhances interfacial charge transport in the ZCS QDs.

Abstract

Integrating ferroelectric materials with semiconductor photocatalysts offers a groundbreaking strategy to enhance solar-driven hydrogen production by improving charge separation and transfer efficiency. Herein, a synergistic system is developed by coupling the tunable ferroelectric polarization of BaTiO3 (BTO) with a Z-scheme heterojunction in Zn0.5Cd0.5S quantum dots (ZCS QDs). The strong and adjustable built-in electric field generated by BTO effectively drives carrier separation, enhances interfacial band bending, and mitigates the excitonic effects commonly observed in QDs, facilitating directional charge transfer. Mechanistic insights, validated by in situ X-ray photoelectron spectroscopy (XPS) and Kelvin Probe Force Microscopy (KPFM), highlight the pivotal role of ferroelectric polarization in modulating carrier dynamics and interfacial interactions. These attributes, resulting from the synergistic effects of ferroelectric polarization and the Z-scheme heterojunction, enable the ZCS QDs/BTO composite to achieve an outstanding hydrogen evolution rate of 0.83 mmol g−1 h−1, surpassing pure BTO and ZCS QDs by factors of 20.8 and 1.7, respectively. Notably, external polarization further amplifies hydrogen production to 1.19 mmol g−1 h−1, representing a remarkable 143% increase compared to the pristine system and showcasing the pivotal role of polarization-enhanced built-in electric fields in photocatalysis. This work presents a novel pathway for designing advanced photocatalysts, providing promising prospects for sustainable hydrogen production.