4.8 Article

In-depth insight into the mechanism on photocatalytic synergistic removal of antibiotics and Cr (VI): The decisive effect of antibiotic molecular structure

Journal

APPLIED CATALYSIS B-ENVIRONMENTAL
Volume 313, Issue -, Pages -

Publisher

ELSEVIER
DOI: 10.1016/j.apcatb.2022.121443

Keywords

Synergistic effect; Antibiotics; Electron-donating ability; Cr (VI); DFT calculation

Funding

  1. National Natural Science Foundation of China [51979081, 52100179]
  2. Fundamental Research Funds for the Central Universities [B210202052]
  3. National Science Funds for Creative Research Groups of China [51421006]
  4. Priority Academic Program Development of Jiangsu Higher Education Institutions (PAPD)

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In this study, a synergistic effect on the photocatalytic removal of antibiotics and hexavalent chromium (Cr (VI)) is achieved using ultra-thin g-C3N4. The mechanism of this synergistic effect is deeply studied at the molecular level through experiments and theoretical calculations. Antibiotics molecules are found to act as electron donors, accelerating the separation of photo-generated electron-hole pairs and increasing the participation of electrons/holes in the redox reaction. Another important finding is the linear relationship between the electron-donating capacity and the synergistic efficiency.
Antibiotics and heavy metal contaminants often coexist in wastewater but their simultaneous/synergistic removal remains a great challenge. Herein, a synergistic effect on the photocatalytic removal of antibiotics and hexavalent chromium (Cr (VI)) is realized using ultra-thin g-C3N4. The mechanism of synergistic effect is studied deeply at molecular level through experiments and theoretical calculation. Antibiotics molecules are first adsorbed on the surface of g-C3N4 by 7C-7C interactions, and subsequently act as electron donors (hole sacrificial agents) to accelerate the separation of photo-generated electron-hole pairs and allow more electrons/holes to participate in the redox reaction. Another crucial finding is that there is a linear relationship between the electron-donating capacity and the synergistic efficiency. Detailly, the contaminant molecules with greater electron-donating capacity are more favorable to the improvement of synergistic efficiency. Our work systematically analyzes the mechanism of synergistic effect on contaminants removal and proposes reasonable methods to enhance the synergistic efficiency.

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