e-Cu共掺杂对SnO2薄膜光电特性的影响
Effects of Ce-Cu Codoping on the Optoelectronic Properties of SnO2 Films
采用溶胶凝胶法制备不同Ce含量的Ce-Cu共掺杂SnO2薄膜。通过实验及第一性原理计算研究了掺杂对SnO2微观结构及光电特性的影响. 结果表明:掺杂后薄膜物相未发生较大变化, Cu、Ce均以替代Sn位形式掺入,形成受主型缺陷。随Ce掺杂浓度增加薄膜晶粒尺寸和光学带隙均减小,电阻率先减小后增大,通过I-V双对数曲线拟合,分析认为Ce掺杂量影响薄膜内陷阱分布从而导致电阻发生改变。PL光谱测试发现SnO2在390 nm处出现紫外发光峰,主要与氧空位有关, Ce3+的5d-4f跃迁在470nm处产生蓝光发光峰,且随掺杂浓度增加发光峰强度先增大后减小并发生红移。第一性原理计算表明Cu 3d态在价带顶上方产生受主能级,而Ce掺杂后使导带整体下移,光带隙减小,进而提高导电性。
he influence of Ce-Cu codoping on the microstructural and optoelectrical properties of SnO2 thin films prepared by sol-gel method has been investigated. Both Cu and Ce dopants are incorporated at substitutional sites , acting as the acceptors. With increasing the Ce content, the film grain size and optical band gap decrease, while the resistivity decreases at first and then increases due to the change of spatial trap distribution. The ultraviolet peak of the films can be attributed to the oxygen vacancies, while the blue emission at 470 nm belongs to the electron transition between 5d-excited state and 4f state of Ce3+ ion. Besides, the intensity of the visible emission peak is influenced by the Ce content. The first-principles calculations suggest that Ce-Cu co-dopants make the conduction band shift down and induce a fully occupied impurity band above the valance band, thus the band gap is decreased and the conductivity is improved.
李建昌、单麟婷
光电子技术半导体技术物理学
e-Cu共掺杂SnO2溶胶凝胶法光电特性第一性原理
e-Cu codoped SnO2sol-gel methodphotoelectric characteristicsfirst-principles
李建昌,单麟婷.e-Cu共掺杂对SnO2薄膜光电特性的影响[EB/OL].(2013-03-20)[2025-08-16].http://www.paper.edu.cn/releasepaper/content/201303-717.点此复制
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