Insights of the adsorption mechanism of ketamine on 3D hierarchically porous carbon: Characterization, experiment and simulation calculation

Shurui Cao,Yan Liu, Yu Tian,Cunxian Xi,Jie Tian,Zhenghong Liu, Jinyou Yang,Zhiqiong Chen

Applied Surface Science（2022）

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摘要

•3D hierarchical porous carbon was prepared by changing ZIF-8 and waste biomass ratio.•The adsorption mechanism of ketamine was investigated by three means.•The optimal adsorption positions of oxygen-rich MBC/MOF were calculated.•Chelation, π-π, H-bond interaction and pore filling were the potential adsorption mechanism.

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关键词

Biochar,Metal-organic framework,Ketamine,Adsorption,Simulation calculation

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