催化作用
甲基环己烷
甲苯
密度泛函理论
纳米颗粒
星团(航天器)
钌
化学
分子
氢气储存
氢
贵金属
组合化学
材料科学
化学工程
计算化学
纳米技术
有机化学
计算机科学
工程类
程序设计语言
作者
Yue Wang,Hancheng Yu,Yurong He,Shengling Xiang,Xuetao Qin,Lini Yang,Jiawei Chen,Yang Si,Jingwang Zhang,Jiangyong Diao,Ning Wang,Mi Peng,Ding Ma,Hongyang Liu
标识
DOI:10.1002/anie.202415542
摘要
Liquid organic hydrogen carriers (LOHCs) are attractive platform molecules that play an important role in hydrogen energy storage and utilization. The multi-step hydrogenation of toluene (TOL) to methylcyclohexane (MCH) has been widely studied in the LOCHs systems, due to their relatively low toxicity and reasonable hydrogen storage capacity. Noble metal catalysts such as Ru has exhibited good performance in multi-step hydrogenation reactions, while the application is still hindered by their high cost and low specific activity. Therefore, the primary challenge lies in the development of noble metal catalysts with both robust activity and efficient atomic utilization. In this study, a series of Ru species ranging from single atoms, fully exposed clusters to nanoparticles were fabricated to investigate their structural evolution in the TOL multi-step hydrogenation reaction. The fully exposed and atomically dispersed Ru clusters, composed of an average of 3 Ru atoms, exhibit superior catalytic performance and recycle ability in TOL multi-step hydrogenation. Moreover, it delivers a high turnover frequency of 9850.3 h
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