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Synthesis of Dimethyl Ether from CO Hydrogenation: a Thermodynamic Analysis of the Influence of Water Gas Shift Reaction
作者姓名:GuangxinJia  YishengTan  YizhuoHan
作者单位:[1]StateKeyLaboratoryofCoalConversion,InstituteofCoalChemistry,ChineseAcademyofSciences,Taiyuan030001,China [2]StateKeyLaboratoryofCoalConversion,InstituteofCoalChemistry,ChineseAcademyofSciences,Taiyuan030001,China//GraduateSchooloftheChineseAcademyofSciences,Beiing100039,China
基金项目:国家高技术研究发展计划(863计划)
摘    要:Three reactions involved in dimethyl ether (DME) synthesis from CO hydrogenation: methanol synthesis reaction (MSR), methanol dehydration reaction (MDR) and water gas shift reaction (WGSR) are studied by thermodynamic calculation. For demonstrating this process in detail, three models, MSR,MSR MDR, MSR MDR WGSR, are used. Their basic characteristics can be obtained by varying widely the ratios of H2 to CO in the feed (no CO2). Through thermodynamic analysis a chemical synergic effect obviously exists in the second and third models. By comparison between two models it is found that WGSR plays a special role in dimethyl ether synthesis. It is possible for the two models to shift one to the other by regulating CO2 concentration in feed. For Model 2, the selectivity for DME in oxygenates (DME methanol) does not change with the ratio of H2 to CO.

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Synthesis of Dimethyl Ether from CO Hydrogenation: a Thermodynamic Analysis of the Influence of Water Gas Shift Reaction
GuangxinJia YishengTan YizhuoHan.Synthesis of Dimethyl Ether from CO Hydrogenation: a Thermodynamic Analysis of the Influence of Water Gas Shift Reaction[J].Journal of Natural Gas Chemistry,2005,14(1):47-53.
Authors:Guangxin Jia  Yisheng Tan  Yizhuo Han
Institution:1. State Key Laboratory of Coal Conversion, Institute of Coal Chemistry, Chinese Academy of Sciences, Taiyuan 030001, China 2. Graduate School of the Chinese Academy of Sciences, Beiing 100039, China
Abstract:Three reactions involved in dimethyl ether (DME) synthesis from CO hydrogenation: methanol synthesis reaction (MSR), methanol dehydration reaction (MDR) and water gas shift reaction (WGSR) are studied by thermodynamic calculation. For demonstrating this process in detail, three models, MSR,MSR MDR, MSR MDR WGSR, are used. Their basic characteristics can be obtained by varying widely the ratios of H2 to CO in the feed (no CO2). Through thermodynamic analysis a chemical synergic effect obviously exists in the second and third models. By comparison between two models it is found that WGSR plays a special role in dimethyl ether synthesis. It is possible for the two models to shift one to the other by regulating CO2 concentration in feed. For Model 2, the selectivity for DME in oxygenates (DME methanol) does not change with the ratio of H2 to CO.
Keywords:dimethyl ether  thermodynamic  syngas  synergic effect  water gas shift reaction
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