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Two-coordinate Cu(I) sites in ZIF-derived porous carbon enable high CO working capacity for CO/N₂ separation.

Created on 15 Jul 2026

Authors

Congli Li, Qingmin Hu, Bin Zheng, Zhengxing Lv, Jiahui Yang, Xuling Guo, Zhitong Zhao, Lei Tang, Rufeng Tian, Qi Shi, Zhe Gao, Jinxiang Dong, Yue-Biao Zhang

Published in

Nature communications. Jul 14, 2026. Epub Jul 14, 2026.

Abstract

Efficient separation of carbon monoxide (CO) from nitrogen (N₂) is vital for recycling steel industry by-product gases and advancing carbon-neutral chemical production. However, current Cu(I)-based π-complexation adsorbents suffer from excessive binding strength and low working capacity. Here we report thermally-dispersed open metal sites (OMS) with two-coordinated Cu(I) units, ( ≡ C-O)CuCl, anchored onto zeolite imidazolate frameworks (ZIFs) derived oxygen-containing porous carbons (ZPC), where the Cu···CO interaction strength is precisely moderated. The optimized adsorbent, 15Cu(I)/ZPC-1, with 15 mmol g⁻¹ Cu(I) dispersed in 10-30 Å pores, delivers a high CO working capacity of 3.21 mmol g⁻¹ (0.1-1 bar, 298 K), the highest among reported recyclable Cu(I)-based adsorbents. The analyses reveal that a low-symmetric trigonal ( ≡ C-O)CuCl···CO coordination geometry weakens π-backbonding, enhances working capacity. Process simulations predict that 15Cu(I)/ZPC-1 enables high productivity and low energy consumption. This work establishes OMS regulation in porous carbon as an effective strategy for efficient CO/N₂ separation.

PMID:
42448690
Bibliographic data and abstract were imported from PubMed on 15 Jul 2026.

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