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Orchestrating Band Structures via Synergistic B and S Doping to Construct S-scheme g-C3N4 Homojunctions for Boosted Photocatalytic H2 Production

Authors: ZHANG Yueting; SONG Changhui; FAN Jipeng; FANG Zhijie; WANG Haitao; MO Man; ZOU Jing

DOI: 10.1007/s40843-026-4299-9Status: Verified Translated Edition
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Key Findings in This Report

• • BSCN homojunction achieves a hydrogen evolution rate of 14.409 mmol g−1 h−1, which is 75-fold and 3.4-fold higher than pristine BCN and SCN, respectively, demonstrating a significant performance leap for practical solar fuel generation. • • DFT calculations reveal a near-thermoneutral ΔGH* of 0.12 eV at S-doped sites, indicating optimized HER kinetics that reduce overpotential losses and enhance catalytic efficiency. • • The interwoven porous nanotube/nanosheet architecture provides a large specific surface area and abundant exposed active sites, improving reactant accessibility and charge transfer kinetics. • • In situ XPS and DFT confirm an S-scheme charge transfer mechanism at the BCN/SCN interface, which effectively suppresses charge recombination and prolongs carrier lifetime, critical for high quantum efficiency.