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Characterization and Computation of Yb/TiO2 and Its Photocatalytic Degradation with Benzohydroxamic Acid

机译:Yb / TiO2的表征计算及苯氧肟酸的光催化降解

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摘要

Yb-doped TiO2 (Yb/TiO2) compositions were synthesized by sol-gel method, and the prepared materials were characterized by X-ray Diffraction (XRD), X-ray photoelectron spectroscopy (XPS), UV-visible diffuse-reflectance spectrum (UV-Vis DRS), transmission electron microscope (TEM) and high resolution transmission electron microscope (HRTEM), energy dispersive spectrometer (EDS), and N2 adsorption. A beneficiation reagent of benzohydroxamic acid (BHA) was used to test the photocatalytic activity of Yb/TiO2. The characterizations indicate that the doping of Yb could inhibit the crystal growth of TiO2, enhance the specific surface area, increase the binding energy of Ti2p, and also slightly expand the adsorption ranges to visible light. Furthermore, the computation of band structure also indicates that Yb-doped TiO2 could make the forbidden band narrower than pure anatase TiO2, which presents a red shift in the absorption spectrum. As a result of the photodegradation experiment on BHA, Yb/TiO2 (0.50% in mass) sintered at 450 °C displayed the highest catalytic activity for BHA when compared with pure TiO2 or other doped Yb/TiO2 compositions, and more than 89.2% of the total organic carbon was removed after 120 min. Almost all anions, including Cl, HCO3, NO3, and SO42−, inhibited the degradation of BHA by Yb/TiO2, and their inhibition effects followed the order of HCO3 > NO3 > SO42− > Cl. Cations of Na+, K+, Ca2+, and Mg2+ displayed a slight suppressing effect due to the impact of Cl coexisting in the solution. In addition, Yb/TiO2 maintained a high photocatalytic ability with respect to BHA after four runs. It is hypothesized that ·OH is one of the main species involved in the photodegradation of BHA, and the mutual transformation of Yb3+ and Yb2+ could promote the separation of electron-hole pairs.
机译:采用溶胶-凝胶法合成了掺Yb的TiO2(Yb / TiO2)组合物,并通过X射线衍射(XRD),X射线光电子能谱(XPS),紫外可见漫反射光谱( UV-Vis DRS),透射电子显微镜(TEM)和高分辨率透射电子显微镜(HRTEM),能量色散光谱仪(EDS)和N2吸附。苯氧肟酸(BHA)的选矿剂用于测试Yb / TiO2的光催化活性。表征表明,Yb的掺杂可以抑制TiO2的晶体生长,增加比表面积,增加Ti2p的结合能,并稍微扩大对可见光的吸附范围。此外,能带结构的计算还表明,掺Yb的TiO2可使禁带比纯锐钛矿型TiO2窄,这在吸收光谱中呈现出红移。作为BHA的光降解实验的结果,与纯TiO2或其他掺杂的Yb / TiO2组合物相比,在450°C烧结的Yb / TiO2(质量为0.50%)对BHA表现出最高的催化活性。 120分钟后,去除了总有机碳。几乎所有的阴离子,包括Cl -,HCO3 -,NO3 -和SO4 2-,均抑制了降解Yb / TiO2对BHA的抑制作用,其抑制作用依次为HCO3 -- 4 2- < / sup Cl -。 Na + ,K + ,Ca 2 + 和Mg 2 + 的阳离子显示出轻微的抑制作用对溶液中共存的Cl -的影响。另外,Yb / TiO 2 经过四次运行后对BHA保持了较高的光催化能力。假设·OH是BHA光降解的主要物质之一,Yb 3 + 和Yb 2 + 的相互转化可以促进BHA的分离。电子-空穴对。

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