Degradation kinetics

降解动力学
  • 文章类型: Journal Article
    (1)背景:制药的使用越来越多,需要长期发展有效的策略,包括定制高度特定的新材料以将其从环境中移除。光催化降解一直是该领域研究人员日益关注的主题。(2)方法:本文主要研究了在TiO2表面沉积一层薄金属层的可能性,并采用理论和实验相结合的方法研究了其光催化降解环丙沙星的性能。(3)结果:基于24d金属在TiO2上的附着力的广泛DFT筛选,选择Cu进行进一步的工作,由于令人满意的预期稳定性和良好的可用性。成功合成了(Cu)TiO2,并用XRD对其进行了表征,SEM+EDS和UV-Vis分光光度法。TiO2表面上均匀分布的铜对应于在高亲和力富氧位点上的结合,如DFT计算所提出的。与裸露的未改性TiO2相比,环丙沙星的光催化降解速率提高了约1.5倍。(4)结论:观察到的结果归因于吸附的Cu能够阻止TiO2的团聚并增加活性催化面积,以及通过DFT计算预测的带隙变窄。
    (1) Background: An increasing use of pharmaceutics imposes a need for the permanent development of efficient strategies, including the tailoring of highly specific new materials for their removal from the environment. Photocatalytic degradation has been the subject of increasing interest of the researchers in the field. (2) Methods: This paper is focused on the investigation of the possibility to deposit a thin metal layer on a TiO2 surface and study its photocatalytic performance for the degradation of ciprofloxacin using a combination of theoretical and experimental methods. (3) Results: Based on the extensive DFT screening of 24 d-metals\' adhesion on TiO2, Cu was selected for further work, due to the satisfactory expected stability and good availability. The (Cu)TiO2 was successfully synthesized and characterized with XRD, SEM+EDS and UV-Vis spectrophotometry. The uniformly distributed copper on the TiO2 surface corresponds to the binding on high-affinity oxygen-rich sites, as proposed with DFT calculations. The photocatalytic degradation rate of ciprofloxacin was improved by about a factor of 1.5 compared to the bare non-modified TiO2. (4) Conclusions: The observed result was ascribed to the ability of adsorbed Cu to impede the agglomeration of TiO2 and increase the active catalytic area, and bandgap narrowing predicted with DFT calculations.
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  • 文章类型: Journal Article
    Neonicotinoid insecticides (NEOs) are commonly used to prevent unwanted insects in urban fields. Degradation processes have been one of the important environmental behaviors of NEOs in an aquatic environment. In this research, hydrolysis, biodegradation, and photolysis processes of four typical NEOs (i.e., thiacloprid (THA), clothianidin (CLO), acetamiprid (ACE), and imidacloprid (IMI)) were examined through the adoption of response surface methodology-central composite design (RSM-CCD) for an urban tidal stream in South China. The influences of multiple environmental parameters and concentration levels on the three degradation processes of these NEOs were then evaluated. The results indicated that the three degradation processes of the typical NEOs followed a pseudo-first-order reaction kinetics model. The primary degradation process of the NEOs were hydrolysis and photolysis processes in the urban stream. The hydrolysis degradation rate of THA was the highest (1.97 × 10-5 s-1), and that of CLO was the lowest (1.28 × 10-5 s-1). The temperature of water samples was the main environmental factor influencing the degradation processes of these NEOs in the urban tidal stream. Salinity and humic acids could inhibit the degradation processes of the NEOs. Under the influence of extreme climate events, the biodegradation processes of these typical NEOs could be suppressed, and other degradation processes could be further accelerated. In addition, extreme climate events could pose severe challenges to the migration and degradation process simulation of NEOs.
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  • 文章类型: Journal Article
    The aim of this communication is to synthesize novel Nanocomposite thin film materials (Ag0(NP)/TiO2) using the template process. Surface morphology of materials was obtained by the Scanning Electron Microscopy (SEM) and Transmission Electron Microscopy (TEM) analyses. The presence of doped Ag-nanoparticles was confirmed by the TEM images along with the SEM-EDX analyses. The Atomic Force Microscopic images were demonstrated the surface roughness and thickness of Nanocomposite thin films. X-ray diffraction analysis confirmed that TiO2 was predominantly present to its anatase mineral phase. The Fourier Transform Infra-red analysis conducted to obtain the functional groups present with the solid. The specific surface area and pore sizes of Nanocomposites were obtained by the BET (Brunauer, Emmett, and Teller) analysis. Further, the Nanocomposite thin film photocatalysts were successfully employed in the degradation of emerging micro-pollutants viz., the antibiotics tetracycline and sulfamethoxazole from aqueous solutions using less harmful UV-A light (λmax 330 nm). The effect of solution pH (pH 4.0-8.0) and pollutant concentrations (1.0 mg/L-20.0 mg/L (for tetracycline) and (0.5 mg/L-15.0 mg/L (for sulfamethoxazole)) was extensively studied in the photocatalytic removal of these antibiotics. A significant decrease in percentage of non-purgeable organic carbon removal indicated that the micro-pollutants was substantially mineralized by the photocatalytic treatment. The stability of thin film was assessed by the repeated use of Nanocomposite thin films and results were indicated that the degradation of tetracycline or sulfamethoxazole was almost unaffected at least for six cycles of photocatalytic operations. The presence of several cations and anions in the degradation of these antibiotics was studied. Additionally, the presence of 2-propanol and EDTA inhibited significantly the degradation of these micro-pollutants i.e., the percentage of degradation was decreased by 31.8 and 24.2% (for tetracycline) and 42.8 and 39.9% (for sulfamethoxazole), respectively. This indicated that the degradation of tetracycline or sulfamethoxazole was predominantly proceeded by the OH radicals; generated at the valance and conduction band of semiconductor. Similarly, the presence of sodium azide inhibited the percentage removal of these antibiotics.
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