Construction of flower-like BiOI/Bi2O2CO3 p-n heterojunction for photocatalytic degradation of Congo Red dye

IF 4.7 2区 化学 Q2 CHEMISTRY, PHYSICAL Journal of Molecular Structure Pub Date : 2025-03-16 DOI:10.1016/j.molstruc.2025.142076
Xiuping Zhang , Yuanyuan Zhong , Tian Xiao , Xiaodong Zhu , Yu Jiao , Qiang Yu , Zhiyong Qi
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Abstract

In this study, Bi2O2CO3 photocatalysts were first synthesized under different hydrothermal temperatures (180 °C, 190 °C, and 200 °C). Congo Red (CR) dye was used as an anionic pollutant model for photocatalytic degradation experiments. The results showed that the photocatalytic performance was optimal at a hydrothermal temperature of 190 °C. Based on this temperature, the modification of Bi2O2CO3 photocatalytic material was studied to solve the problems of easy recombination of photogenerated charge and insufficient quantum utilization. BiOI was coupled with Bi2O2CO3, which has matched band structures, to construct a BiOI/Bi2O2CO3 (BiOI/BOC) p-n heterojunction composite photocatalysts. Photocatalytic degradation experiments indicated that the BiOI/BOC composite with a molar ratio of 0.5 exhibited the highest photocatalytic activity. After 60 min of light irradiation, the degradation degree reached 78.7 %, and the first-order reaction rate constant was 0.0207 min⁻1, which is 2.5 times that of pure BOC (0.0083 min–1) and 3.1 times that of BiOI (0.0067 min–1). The enhanced photocatalytic activity of the BiOI/Bi2O2CO3 composites are attributed to the formation of p-n heterojunction at the contact interface between BiOI and Bi2O2CO3. In the p-n heterojunction, the significant difference in Fermi energy levels between the two results in a strong built-in electric field. Driven by the built-in electric field, e⁻ in the CB of BiOI migrates to CB of Bi2O2CO3, and h⁺ in the VB of Bi2O2CO3 migrates to VB of BiOI, effectively promoting the separation of photogenerated carriers and thus enhancing photocatalytic activity. The photocatalytic degradation mechanism of the BiOI/BOC p-n heterojunction was proposed based on electrochemical tests and active species experiments.
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花状BiOI/Bi2O2CO3 p-n异质结光催化降解刚果红染料的构建
本研究首先在不同水热温度(180 ℃、190 ℃ 和 200 ℃)下合成了 Bi2O2CO3 光催化剂。以刚果红(CR)染料为阴离子污染物模型进行光催化降解实验。结果表明,水热温度为 190 ℃ 时光催化性能最佳。在此温度基础上,研究了对 Bi2O2CO3 光催化材料的改性,以解决光生电荷易重组和量子利用率不足的问题。将 BiOI 与具有匹配能带结构的 Bi2O2CO3 相耦合,构建了 BiOI/Bi2O2CO3 (BiOI/BOC)p-n 异质结复合光催化剂。光催化降解实验表明,摩尔比为 0.5 的 BiOI/BOC 复合材料具有最高的光催化活性。光照射 60 分钟后,降解率达到 78.7%,一阶反应速率常数为 0.0207 min-1,是纯 BOC(0.0083 min-1)的 2.5 倍,BiOI(0.0067 min-1)的 3.1 倍。BiOI/Bi2O2CO3 复合材料光催化活性的增强归因于 BiOI 和 Bi2O2CO3 接触界面上形成的 p-n 异质结。在 p-n 异质结中,两者之间费米能级的显著差异导致了强大的内置电场。在内置电场的驱动下,BiOI 的 CB 中的 e- 迁移到 Bi2O2CO3 的 CB 中,Bi2O2CO3 的 VB 中的 h⁺ 迁移到 BiOI 的 VB 中,有效地促进了光生载流子的分离,从而提高了光催化活性。基于电化学测试和活性物种实验,提出了 BiOI/BOC p-n 异质结的光催化降解机理。
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来源期刊
Journal of Molecular Structure
Journal of Molecular Structure 化学-物理化学
CiteScore
7.10
自引率
15.80%
发文量
2384
审稿时长
45 days
期刊介绍: The Journal of Molecular Structure is dedicated to the publication of full-length articles and review papers, providing important new structural information on all types of chemical species including: • Stable and unstable molecules in all types of environments (vapour, molecular beam, liquid, solution, liquid crystal, solid state, matrix-isolated, surface-absorbed etc.) • Chemical intermediates • Molecules in excited states • Biological molecules • Polymers. The methods used may include any combination of spectroscopic and non-spectroscopic techniques, for example: • Infrared spectroscopy (mid, far, near) • Raman spectroscopy and non-linear Raman methods (CARS, etc.) • Electronic absorption spectroscopy • Optical rotatory dispersion and circular dichroism • Fluorescence and phosphorescence techniques • Electron spectroscopies (PES, XPS), EXAFS, etc. • Microwave spectroscopy • Electron diffraction • NMR and ESR spectroscopies • Mössbauer spectroscopy • X-ray crystallography • Charge Density Analyses • Computational Studies (supplementing experimental methods) We encourage publications combining theoretical and experimental approaches. The structural insights gained by the studies should be correlated with the properties, activity and/ or reactivity of the molecule under investigation and the relevance of this molecule and its implications should be discussed.
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