Design of visible light responsive photocatalysts for selective reduction of chlorinated organic compounds in water
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- 作者：Junfeng Niua ; junfengn@bnu.edu.cn" class="auth_mail" title="E-mail the corresponding author ; Lifeng Yina ; lfyin@bnu.edu.cn" class="auth_mail" title="E-mail the corresponding author ; Yunrong Daia ; daiyr@craes.org.cn" class="auth_mail" title="E-mail the corresponding author ; Yueping Baoa ; baoyueping@mail.bnu.edu.cn" class="auth_mail" title="E-mail the corresponding author ; John C. Crittendena ; b ; john.Crittenden@ce.gatech.edu" class="auth_mail" title="E-mail the corresponding author
- 关键词：First principle theory ; Density functional theory ; Photocatalyst ; Photocatalytic reduction ; Chlorinated organic pollutants
- 刊名：Applied Catalysis A: General
- 出版年：2016
- 出版时间：5 July 2016
- 年：2016
- 卷：521
- 期：Complete
- 页码：90-95
- 全文大小：1174 K
文摘
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DFT calculation was performed for β-Bi2O3 photocatalyst modified with 32 elements.
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Photocatalysts good at COCs reduction were designed by theoretical calculation.
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Periodic change of photocatalyst feature is from the periodicity of doped elements.
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