中国科学院机构知识库网格
Chinese Academy of Sciences Institutional Repositories Grid
Detailed kinetic study of fischer-tropsch synthesis on co/zro2/sio2 catalyst i. analysis of reaction pathways

文献类型:期刊论文

作者Chang, J; Teng, BT; Bai, L; Zhang, RL; Chen, JG; Xu, YY; Xiang, HW; Li, YW; Sun, YH
刊名Chinese journal of catalysis
出版日期2005-07-01
卷号26期号:7页码:614-620
关键词Cobalt-based catalyst Fischer-tropsch synthesis Reaction kinetics Reaction pathway Energetic analysis Unsteady state experiment
ISSN号0253-9837
通讯作者Chang, j()
英文摘要Mechanistic analysis for the fischer-tropsch (f-t) synthesis has been conducted to resolve the tedious task in assembling a mass of model equations in its kinetic studies. using the unity bond index-quadratic exponential potential (ubi-qep) method, it is found that on the model cobalt-based catalyst co(0001) surface, the surface carbide mechanism via ch2,s insertion into the oxygen-free intermediates is energetically favorable. the dissociation of co and the first hydrogenation of surface carbon have higher active barriers than the other elementary steps. the unsteady state experiments show that the formation of h2o is the most important way to remove the surface oxygen at the f-t synthesis temperature on co/zro2/sio2. the formation and consequent hydrogenation of c, is the rate- determining step in the reaction pathway, while the c-c coupling is a relatively faster elementary reaction. there are more carbon pools for the methane formation, and the deviation of the methane product from the classical anderson- schulz-flory product distribution might be due to the multiform carbon pools. combining the results of theoretical and experimental analysis, a framework of f-t synthesis mechanistic models is obtained. this framework is similar to the surface carbide mechanism, in which the co, dissociation or the surface carbon hydrogenation is the rate- determining step, and the ch2,s insertion produces the final hydrocarbons. but the detail forms of the oxygen-free intermediates (alkyl or alkylidene) in the carbon chain propagation cannot be discriminated. this will be resolved by the kinetic analysis in the next part of this series work.
WOS关键词CO HYDROGENATION ; HYDROCARBON SYNTHESIS ; SUPPORTED COBALT ; SPECTROSCOPY ; ADSORPTION ; MECHANISM
WOS研究方向Chemistry ; Engineering
WOS类目Chemistry, Applied ; Chemistry, Physical ; Engineering, Chemical
语种英语
WOS记录号WOS:000230982300019
出版者SCIENCE PRESS
URI标识http://www.irgrid.ac.cn/handle/1471x/2377765
专题中国科学院大学
通讯作者Chang, J
作者单位1.Chinese Acad Sci, Inst Coal Chem, State Key Lab Coal Convers, Taiyuan 030001, Shanxi, Peoples R China
2.Chinese Acad Sci, Grad Sch, Beijing 100039, Peoples R China
推荐引用方式
GB/T 7714
Chang, J,Teng, BT,Bai, L,et al. Detailed kinetic study of fischer-tropsch synthesis on co/zro2/sio2 catalyst i. analysis of reaction pathways[J]. Chinese journal of catalysis,2005,26(7):614-620.
APA Chang, J.,Teng, BT.,Bai, L.,Zhang, RL.,Chen, JG.,...&Sun, YH.(2005).Detailed kinetic study of fischer-tropsch synthesis on co/zro2/sio2 catalyst i. analysis of reaction pathways.Chinese journal of catalysis,26(7),614-620.
MLA Chang, J,et al."Detailed kinetic study of fischer-tropsch synthesis on co/zro2/sio2 catalyst i. analysis of reaction pathways".Chinese journal of catalysis 26.7(2005):614-620.

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来源:中国科学院大学

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