共价键
咪唑
亚胺
密度泛函理论
部分
光化学
接受者
光催化
材料科学
电子转移
共价有机骨架
化学
计算化学
立体化学
催化作用
有机化学
物理
凝聚态物理
作者
Cong‐Xue Liu,Donglai Pan,Younggyu Seo,Seungjae Park,Jing‐Lan Kan,Jin Young Koo,Wonyong Choi,Eunsung Lee
出处
期刊:ACS applied energy materials
[American Chemical Society]
日期:2023-01-06
卷期号:6 (2): 1126-1133
被引量:5
标识
DOI:10.1021/acsaem.2c03897
摘要
The rational design of organic semiconductors based on crystalline covalent organic frameworks (COFs) as efficient photocatalysts is highly desirable. In this study, the first example of phenanthroimidazole-based COFs is reported: PIm-COF1 with an imine linkage and PIm-COF2 with a β-ketoenamine-linkage. Both COF materials showed substantial optical properties. The average hydrogen evolution rate was 7417.5 μmolg–1 h–1 for PIm-COF2, which was 14 times higher than that of PIm-COF1 (528.5 μmolg–1 h–1). This can be attributed to the strong donor–acceptor effect of PIm-COF2 and the continuous separation and transfer of the photoexcited electron–hole pair from the phenanthro[9,10-d] imidazole moiety which are verified by time-dependent density functional theory and excitation state analysis.
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