催化作用
单线态氧
降级(电信)
化学工程
选择性
纳米技术
碳纳米管
环境污染
纳米颗粒
污染
密度泛函理论
化学
材料科学
氧气
环境科学
有机化学
计算化学
计算机科学
工程类
生物
电信
环境保护
生态学
作者
Tongcai Liu,Shaoze Xiao,Nan Li,Jiabin Chen,Xuefei Zhou,Yajie Qian,Ching‐Hua Huang,Yalei Zhang
标识
DOI:10.1038/s41467-023-38677-1
摘要
Abstract There is an urgent need to develop effective and sustainable solutions to reduce water pollution. Heterogeneous Fenton-like catalysts are frequently used to eliminate contaminants from water. However, the applicability of these catalysts is limited due to low availability of the reactive species (RS). Herein, nanoconfinement strategy was applied to encapsulate short-lived RS at nanoscale to boost the utilization efficiency of the RS in Fenton-like reactions. The nanoconfined catalyst was fabricated by assembling Co 3 O 4 nanoparticles in carbon nanotube nanochannels to achieve exceptional reaction rate and excellent selectivity. Experiments collectively suggested that the degradation of contaminants was attributed to singlet oxygen ( 1 O 2 ). Density functional theory calculations demonstrated the nanoconfined space contributes to quantum mutation and alters the transition state to lower activation energy barriers. Simulation results revealed that the enrichment of contaminant on the catalyst reduced the migration distance and enhanced the utilization of 1 O 2 . The synergy between the shell layer and core-shell structure further improved the selectivity of 1 O 2 towards contaminant oxidation in real waters. The nanoconfined catalyst is expected to provide a viable strategy for water pollution control.
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