首页|CeO2催化CO2与甲醇合成碳酸二甲酯

CeO2催化CO2与甲醇合成碳酸二甲酯

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针对CO2和甲醇绿色合成碳酸二甲酯路线进行热力学计算分析.在反应压力0.1-8.0 MPa和反应温度293.15-473.15 K分别研究反应温度和反应压力对吉布斯自由能△rG、平衡常数K和平衡转化率C的影响.在此基础上,以CeO2为催化剂分别固定反应压力8.0 MPa或反应温度413.15 K,在不同反应温度或压力下进行反应,并将实验结果与热力学计算结果进行对比.结果表明:CeO2在反应温度为373.15-473.15 K内表现出良好的催化性能,增大反应压力可以有效降低△rG,并提高K和C,促进反应正向进行.此外,热力学计算结果显示,较低温度不同反应压力条件下,增加反应压力对反应平衡常数的增大更显著,且为开发高活性催化材料在较低温下催化CO2和甲醇高效合成碳酸二甲酯提供理论参考.
Synthesis of dimethyl carbonate from CO2 and methanol catalyzed by CeO2
The green synthesis process of dimethyl carbonate from CO2 and methanol was researched with thermodynamic calculation.The effects of reaction temperature and pressure on Gibbs free energy △rG,equilibrium constant K and equilibrium conversion rate C were studied in the range of 0.1-8.0 MPa and 293.15-473.15 K.Furthermore,the effects of temperatures and pressures on the reaction performance were investigated by using CeO2 as the catalyst at a fixed reaction pressure of 8.0 MPa or a reaction temperature of 413.15 K,and the obtained results were compared with the results of thermodynamic calculations.The results show that CeO2 gives a good performance in the range of 373.15-473.15 K,and the increase of reaction pressure can reduce △rG and increase K and C,promoting the reaction in the positive direction.In addition,thermodynamic calculations show that the reaction pressure displays a more significant effect on the equilibrium constant under the condition of lower reaction temperature with different reaction pressure,and provides a theoretical reference for the development of highly active catalytic materials to catalyze the efficient synthesis of dimethyl carbonate from CO2and methanol at lower temperatures.

thermodynamic calculationdimethyl carbonateCO2methanolCeO2

李建国、贾爱忠、薛伟、赵新强、王延吉

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河北工业大学化工学院,天津 300130

热力学计算 碳酸二甲酯 CO2 甲醇 CeO2

中央引导地方科技发展资金项目河北省自然科学基金资助项目天津市自然科学基金资助项目

216Z3701GB202220203415JCYBJC2100

2024

化学工程
华陆工程科技有限责任公司

化学工程

CSTPCD北大核心
影响因子:0.438
ISSN:1005-9954
年,卷(期):2024.52(1)
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