Knowledge Management System Of Guangzhou Institute of Energy Conversion, CAS
Efficient Synthesis of Ethanol from CH4 and Syngas on a Cu-Co/TiO2 Catalyst Using a Stepwise Reactor | |
Zuo, Zhi-Jun1; Peng, Fen1,2; Huang, Wei1 | |
2016-10-03 | |
发表期刊 | SCIENTIFIC REPORTS |
卷号 | 6 |
摘要 | Ethanol synthesis from CH4 and syngas on a Cu-Co/TiO2 catalyst is studied using experiments, density functional theory (DFT) and microkinetic modelling. The experimental results indicate that the active sites of ethanol synthesis from CH4 and syngas are Cu and CoO, over which the ethanol selectivity is approximately 98.30% in a continuous stepwise reactor. DFT and microkinetic modelling results show that *CH3 is the most abundant species and can be formed from *CH4 dehydrogenation or through the process of *CO hydrogenation. Next, the insertion of *CO into *CH3 forms *CH3CO. Finally, ethanol is formed through *CH3CO and *CH3COH hydrogenation. According to our results, small particles of metallic Cu and CoO as well as a strongly synergistic effect between metallic Cu and CoO are beneficial for ethanol synthesis from CH4 and syngas on a Cu-Co/TiO2 catalyst. |
文章类型 | Article |
WOS标题词 | Science & Technology |
DOI | 10.1038/srep34670 |
研究领域[WOS] | Science & Technology - Other Topics |
关键词[WOS] | DENSITY-FUNCTIONAL THEORY ; TEMPERATURE WGS REACTION ; PEROVSKITE-TYPE OXIDES ; CU-BASED CATALYSTS ; METHANOL DECOMPOSITION ; HYDROGEN-PRODUCTION ; HIGHER ALCOHOLS ; THIN-FILMS ; CO ; CONVERSION |
收录类别 | SCI |
语种 | 英语 |
项目资助者 | National Basic Research Program of China(2011CB211709) ; key project of the National Natural Science Foundation of China(21336006) ; National Natural Science Foundation of China(21176167 ; key project of Basic Industrial Research of Shanxi(201603D121014) ; Program for the Outstanding Innovative Teams of Higher Learning Institutions of Shanxi ; 21306125) |
WOS类目 | Multidisciplinary Sciences |
WOS记录号 | WOS:000385058600001 |
引用统计 | |
文献类型 | 期刊论文 |
条目标识符 | http://ir.giec.ac.cn/handle/344007/13949 |
专题 | 中国科学院广州能源研究所 |
作者单位 | 1.Taiyuan Univ Technol, Minist Educ & Shanxi Prov, Key Lab Coal Sci & Technol, Taiyuan 030024, Shanxi, Peoples R China 2.Chinese Acad Sci, Guangzhou Inst Energy Convers, Key Lab Renewable Energy & Gas Hydrate, Guangzhou, Guangdong, Peoples R China |
推荐引用方式 GB/T 7714 | Zuo, Zhi-Jun,Peng, Fen,Huang, Wei. Efficient Synthesis of Ethanol from CH4 and Syngas on a Cu-Co/TiO2 Catalyst Using a Stepwise Reactor[J]. SCIENTIFIC REPORTS,2016,6. |
APA | Zuo, Zhi-Jun,Peng, Fen,&Huang, Wei.(2016).Efficient Synthesis of Ethanol from CH4 and Syngas on a Cu-Co/TiO2 Catalyst Using a Stepwise Reactor.SCIENTIFIC REPORTS,6. |
MLA | Zuo, Zhi-Jun,et al."Efficient Synthesis of Ethanol from CH4 and Syngas on a Cu-Co/TiO2 Catalyst Using a Stepwise Reactor".SCIENTIFIC REPORTS 6(2016). |
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