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Active Sites Decorated Nonpolar Pore-Based MOF for One-step Acquisition of C2H4 and Recovery of C3H6
Authors:Dr Gang-Ding Wang  Dr Yong-Zhi Li  Dr Wen-Juan Shi  Prof Lei Hou  Prof Yao-Yu Wang  Prof Zhonghua Zhu
Institution:1. Key Laboratory of Synthetic and Natural Functional Molecule of the Ministry of Education, College of Chemistry & Materials Science, Northwest University, Xi'an, 710069 P. R. China

Contribution: Data curation (lead), ​Investigation (lead), Methodology (equal), Writing - original draft (lead);2. Key Laboratory of Synthetic and Natural Functional Molecule of the Ministry of Education, College of Chemistry & Materials Science, Northwest University, Xi'an, 710069 P. R. China

Contribution: Data curation (equal), Formal analysis (equal), Writing - review & editing (supporting);3. Key Laboratory of Synthetic and Natural Functional Molecule of the Ministry of Education, College of Chemistry & Materials Science, Northwest University, Xi'an, 710069 P. R. China

Contribution: Formal analysis (equal), Software (equal);4. Key Laboratory of Synthetic and Natural Functional Molecule of the Ministry of Education, College of Chemistry & Materials Science, Northwest University, Xi'an, 710069 P. R. China;5. Key Laboratory of Synthetic and Natural Functional Molecule of the Ministry of Education, College of Chemistry & Materials Science, Northwest University, Xi'an, 710069 P. R. China

Contribution: Formal analysis (equal), Resources (equal);6. School of Chemical Engineering, The University of Queensland, Brisbane, 4072 Australia

Contribution: Formal analysis (equal), Software (equal)

Abstract:Herein, a 2-fold interpenetrated metal-organic framework (MOF) Zn-BPZ-TATB with accessible N/O active sites in nonpolar pore surfaces was reported for one-step C2H4 purification from C2H6 or C3H6 mixtures as well as recovery of C3H6 from C2H6/C3H6/C2H4 mixtures. The MOF exhibits the favorable C2H6 and C3H6 uptakes (>100 cm3 g−1 at 298 K under 100 kPa) as well as selective adsorption of C2H6 and C3H6 over C2H4. The C3H6- and C2H6-selective feature were investigated detailedly by experimental tests as well as sorption kinetic studyies. Molecular modelling revealed the multiple interactions between C3H6 or C2H6 molecules and methyl groups as well as triazine rings in pores. Zn-BPZ-TATB not only can directly generate 323.4 L kg−1 and 15.4 L kg−1 of high-purity (≥99.9 %) C2H4 from C3H6/C2H4 and C2H6/C2H4 mixtures, but also provide a large high-purity (≥99.5 %) C3H6 recovery capacity of 60.1 L kg−1 from C3H6/C2H4 mixtures. More importantly, the high-purity C3H6 (≥99.5 %) and C2H4 (≥99.9 %) with the productivities of 38.2 and 12.7 L kg−1 can be simultaneously obtained from C2H6/C3H6/C2H4 mixtures through a single adsorption/desorption cycle.
Keywords:Crystal Structure  Ethylene Purification  Gas Adsorption and Separation  Metal–Organic Framework  Microporous Materials
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