Two amino-functionalized metal-organic frameworks with different topologies for C2H2/C2H4 separation

IF 4.3 3区 材料科学 Q1 ENGINEERING, ELECTRICAL & ELECTRONIC ACS Applied Electronic Materials Pub Date : 2024-11-06 DOI:10.1039/d4dt02592j
Yue Li, Mingming Xu, Hongyan Liu, Xiaokang Wang, Yutong Wang, Meng Sun, Weidong Fan, Daofeng Sun
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Abstract

The rational design of metal-organic framework adsorbents is crucial for target gas separation. Herein, we report two three-dimensional MOFs with different topologies by regulating metal ions with amino-functionalized V-type ligands. Adsorption isotherms and Grand Canonical Monte Carlo simulation reveal that UPC-122 with channel-cavity structure has the potential to separate C2H2/C2H4 at room temperature with a separation ratio of 2.35 (50/50).
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两种拓扑结构不同的氨基功能化金属有机框架用于分离 C2H2/C2H4
合理设计金属有机框架吸附剂对于目标气体分离至关重要。在此,我们通过用氨基功能化的 V 型配体调节金属离子,报告了两种具有不同拓扑结构的三维 MOFs。吸附等温线和大卡农蒙特卡洛模拟显示,具有通道空腔结构的 UPC-122 具有在室温下分离 C2H2/C2H4 的潜力,分离比为 2.35(50/50)。
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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来源期刊
CiteScore
7.20
自引率
4.30%
发文量
567
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