کد مقاله | کد نشریه | سال انتشار | مقاله انگلیسی | نسخه تمام متن |
---|---|---|---|---|
5488163 | 1524073 | 2017 | 27 صفحه PDF | دانلود رایگان |
عنوان انگلیسی مقاله ISI
The photocatalytic mechanism of BiOI with oxygen vacancy and iodine self-doping
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کلمات کلیدی
موضوعات مرتبط
مهندسی و علوم پایه
فیزیک و نجوم
فیزیک اتمی و مولکولی و اپتیک
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چکیده انگلیسی
The photocatalytic mechanism of BiOI with an oxygen vacancy and iodine self-doping is investigated by studying their structural, electronic and optical properties. The results of the first-principle calculations indicate that the utilization of the visible light region is broadened, and thus the photocatalytic performance is improved, via introducing an oxygen vacancy or I dopant. Among them, I-Bi doped BiOI shows the best photocatalytic performance, and it is also the preferred one of the three structures due to its better stability. The occurrence of I-Bi or I-I interactions in the original double iodine layer along with the introduction of I dopant leads to a planar localization of the photocatalytic mechanism. Then it is expected that the photo-generated carriers will transfer to the catalyst surface more easily; the photocatalytic activity of BiOI relies on the planar localization to a great degree.
ناشر
Database: Elsevier - ScienceDirect (ساینس دایرکت)
Journal: Chinese Journal of Physics - Volume 55, Issue 2, April 2017, Pages 331-341
Journal: Chinese Journal of Physics - Volume 55, Issue 2, April 2017, Pages 331-341
نویسندگان
Ting Kong, Xiumei Wei, Gangqiang Zhu, Yuhong Huang,