沸石咪唑盐骨架
纳米孔
支化(高分子化学)
吸附
化学
咪唑酯
分离(统计)
酒
分离法
化学工程
金属有机骨架
有机化学
色谱法
计算机科学
机器学习
工程类
作者
Rocío Bueno-Pérez,Juan José Gutiérrez‐Sevillano,David Dubbeldam,Patrick J. Merkling,Sofı́a Calero
出处
期刊:ChemPhysChem
[Wiley]
日期:2015-07-16
卷期号:16 (13): 2735-2738
被引量:8
标识
DOI:10.1002/cphc.201500319
摘要
Abstract The separation of pentanol isomer mixtures is shown to be very efficient using the nanoporous adsorbent zeolitic imidazolate framework ZIF‐77. Through molecular simulations, we demonstrate that this material achieves a complete separation of linear from monobranched—and these from dibranched—isomers. Remarkably, the adsorption and diffusion behaviors follow the same decreasing trend, produced by the channel size of ZIF‐77 and the guest shape. This separation based on molecular branching applies to alkanes and alcohols and promises to encompass numerous other functional groups.
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