The adsorption characteristics and degradation mechanism of tinidazole on an anatase TiO2 surface: a DFT study

Author:

Qin Qiaoqiao1234,Qin Haichuan1234,Li Kai1234,Tan Ruolan5674,Liu Xiangyang1234,Li Laicai1234ORCID

Affiliation:

1. College of Chemistry and Material Science

2. Sichuan Normal University

3. Chengdu 610068

4. China

5. College of Pharmacy

6. Southwestern Medical University

7. Luzhou

Abstract

The adsorption characteristics and degradation mechanism of tinidazole on TiO2(101) and (001) surfaces under vacuum and aqueous solution conditions were studied by density functional theory (DFT).

Publisher

Royal Society of Chemistry (RSC)

Subject

General Chemical Engineering,General Chemistry

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