从二氧化碳/C2H2/C2H4 三元气体混合物中一步法生产乙烯的柱层配位网络。

Chem & Bio Engineering Pub Date : 2024-08-27 eCollection Date: 2025-01-23 DOI:10.1021/cbe.4c00113
Rong Yang, Tao Zhang, Jinbo Wang, Xue Zhang, Jian-Wei Cao, Yu Wang, Kai-Jie Chen
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摘要

由于所涉及的气体分子高度相似,从多组分混合物中一步分离乙烯(C2H4)在石化工业中提出了重大挑战。在此,我们报道了一个柱状层配位网络,命名为Zn-fa-mtrz (H2fa =富马酸;Hmtrz = 3-甲基-1,2,4-三唑),具有由甲基和电负性N/O原子修饰的孔表面。分子模拟结果表明,相对于C2H4, Zn-fa-mtrz的孔表面提供了更多更强的多重相互作用位点,从而同时增强了对CO2和C2H2的吸附亲和力。实验和模拟突破性实验表明,从CO2/C2H2/C2H4三元气体混合物中一步制得高纯度C2H4(>99.97%)的能力。
本文章由计算机程序翻译,如有差异,请以英文原文为准。

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A Pillared-Layer Coordination Network for One-Step Ethylene Production from Ternary CO2/C2H2/C2H4 Gas Mixture.

One-step separation of ethylene (C2H4) from multicomponent mixtures poses significant challenges in the petrochemical industry due to the high similarity of involved gas molecules. Herein, we report a pillared-layer coordination network named Zn-fa-mtrz (H2fa = fumaric acid; Hmtrz = 3-methyl-1,2,4-triazole) possessing pore surfaces decorated with methyl groups and electronegative N/O atoms. Molecular modeling reveals that the pore surface of Zn-fa-mtrz provides more and stronger multiple interaction sites to simultaneously enhance the adsorption affinity for CO2 and C2H2 other than C2H4. The experimental and simulated breakthrough experiments demonstrate the ability to produce high-purity C2H4 (>99.97%) in one-step from ternary CO2/C2H2/C2H4 gas mixtures.

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