Sub-Ångstrom Pore Engineering in Carbon Molecular Sieves Realizes Diffusion-Gated Kinetic Sieving of Alkenes from Alkanes.

Fuqiang Chen, Hua Shang, Guangtong Hai, Xinlei Huang, Zhe Chu, Haoran Sun, Liu Yang, Qiwei Yang, Zhiguo Zhang, Qilong Ren, Zongbi Bao
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Abstract

Sub-ångstrom pore engineering offers a new paradigm for molecular separations. Here, we report sucrose-derived carbon molecular sieves with precisely tailored sub-ångstrom slit pores that enable diffusion-gated kinetic sieving for the challenging separation of alkenes from alkanes. The optimized materials, C-Suc-650 and C-Suc-750, set new industry-leading standards for the kinetic separation of C3H6/C3H8 and C2H4/C2H6, respectively. Through a combination of breakthrough experiments, pressure swing adsorption (PSA) simulations, and molecular dynamics modeling, we demonstrate that these sieves consistently achieve >99.9% alkene purity, with outstanding selectivity, rapid uptake kinetics, and remarkably low energy consumption. Mechanistic studies reveal that slit pore architecture uniquely enhances alkene diffusion while hindering alkane movement, establishing a clear design principle for next-generation, energy-efficient gas separations. These results provide a blueprint for exploiting diffusion-gated kinetic sieving at the sub-ångstrom scale to address longstanding challenges in industrial gas purification.

碳分子筛的亚-Ångstrom孔工程实现了从烷烃中分离烯烃的扩散门控动力学筛分。
孔径工程为分子分离提供了一种新的范例。在这里,我们报告了蔗糖衍生的碳分子筛具有精确定制的亚孔径狭缝孔,使扩散门控动力学筛分能够从烷烃中分离烯烃。优化后的材料c- su -650和c- su -750分别为C3H6/C3H8和C2H4/C2H6的动力学分离设定了新的行业领先标准。通过突破性实验、变压吸附(PSA)模拟和分子动力学建模的结合,我们证明了这些筛子始终可以达到bb0 - 99.9%的烯烃纯度,具有出色的选择性、快速的吸收动力学和显著的低能耗。机理研究表明,缝状孔隙结构独特地增强了烯烃的扩散,同时阻碍了烷烃的运动,为下一代节能气体分离建立了明确的设计原则。这些结果为在亚纳米尺度上利用扩散门控动力学筛分来解决工业气体净化中长期存在的挑战提供了蓝图。
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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