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Loading Nickel Atoms on GDY for Efficient CO_(2) Fixation and Conversion

查看全文 作  者:ZHENG [1]Zhiqiang;HE [2,3]Feng;XUE [1,2]Yurui;LI [1,2,3]Yuliang 高影响力作者 机构地区:[1]Science Center for Material Creation and Energy Conversion,School of Chemistry and Chemical Engineering,Institute of Frontier and Interdisciplinary Science,Shandong University,Jinan 250100,P.R.China;[2]Institute of Chemistry,Chinese Academy of Sciences,Beijing 100190,P.R.China;[3]University of Chinese Academy of Sciences,Beijing 100049,P.R.China高影响力机构 出  处:《Chemical Research in Chinese Universities》索引2022年第38卷第1期,共7页高影响力期刊 基  金:This work was supported by the National Key Research and Development Project of China(No.2018YFA0703501);the National Natural Science Foundation of China(Nos.21790050,21790051,22021002);the Key Program of the Chinese Academy of Sciences(No.QYZDY-SSW-SLH015). 摘  要:Carbon dioxide(CO_(2))is an important and valuable C1 resource for the synthesis of numerous of value-added products. However, efficient fixation and conversion of CO_(2) into organic carbonates under mild conditions remain great challenges. Herein, graphdiyne(GDY)-based nickel atomic catalysts(Ni0/GDYs) were synthesized through a facile in-situ reduction method. Experimental results showed that the obtained Ni0/GDY had outstanding catalytic performances for converting CO_(2) into cyclic carbonates with a high reaction conversion(99%) and reaction selectivity(ca. 100%) at 80℃ and under 1 atm(1 atm=101325 Pa). Specially, the activation energy (Ea) value for the Ni0/GDY is 37.05 kJ/mol, lower than those of reported catalysts. The reaction mechanism was next carefully analyzed by using density functional theory(DFT) calculations. Such an excellent catalytic property could be mainly attributed to the high dispersion of active sites on the Ni0/GDY, and the unique incomplete charge transfer properties of GDY-based zero-valent metallic catalysts. 关 键 词:Graphdiyne Atomic catalyst Atomic catalysis CO_(2)fixation CO_(2)conversion
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