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METAL ORGANIC FRAMEWORK WITH TWO ACCESSIBLE BINDING SITES PER METAL CENTER FOR GAS SEPARATION AND GAS STORAGE
METAL ORGANIC FRAMEWORK WITH TWO ACCESSIBLE BINDING SITES PER METAL CENTER FOR GAS SEPARATION AND GAS STORAGE
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机译:每个金属中心具有两个可访问的绑定站点的金属有机框架,用于气体分离和气体存储
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摘要
The separation of ethane from its corresponding ethylene is a very important, challenging and energy-intensive process in the chemical industry. Herein we report a microporous metal-organic framework Fe2(O2)(dobdc) (dobdc4−: 2,5-dioxido-1,4-benzenedicarboxylate) with Fe-peroxo sites for the preferential binding of ethane over ethylene and thus highly selective separation of C2H6/C2H4. Neutron powder diffraction studies and theoretical calculations demonstrate the key role of Fe-peroxo sites for the recognition of ethane. The high performance of Fe2(O2)(dobdc) for the ethane/ethylene separation has been validated by gas sorption isotherms, ideal adsorbed solution theory calculations, simulated and experimental breakthrough curves. Through a fixed-bed column packed with this porous material, polymer-grade of ethylene (99.99%) can be straightforwardly produced from ethane/ethylene mixtures during the first adsorption cycle, demonstrating its enormous potential for this very important industrial separation with low energy cost
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机译:在化学工业中,将乙烷与相应的乙烯分离是非常重要,具有挑战性和能源密集型的过程。本文中我们报道了一种微孔金属有机骨架Fe 2 Sub>(O 2 Sub>)(dobdc)(dobdc 4- Sup>:2,5-dioxido- 1,4-苯二甲酸)具有铁过氧位点的乙烷比乙烯优先结合,因此可高度选择性地分离C 2 Sub> H 6 Sub> / C 2 < / Sub> H 4 Sub>。中子粉末衍射研究和理论计算证明了Fe-过氧位点在识别乙烷中的关键作用。 Fe 2 Sub>(O 2 Sub>)(dobdc)在乙烷/乙烯分离方面的高性能已通过气体吸附等温线,理想的吸附溶液理论计算,模拟和实验得到了验证突破曲线。通过填充有这种多孔材料的固定床色谱柱,可以在第一个吸附循环中直接从乙烷/乙烯混合物中生产聚合物级的乙烯(99.99%),证明了其在这一非常重要的工业分离中具有巨大的潜力,且成本低廉。
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