55 citations · 70 across the 5 of their papers we have counts for
5 papers
Multidimensional Design of Metal-Nitrogen-Carbon Electrocatalysts for Direct Propylene Epoxidation
Songbo Ye, Qingyuan Han, Jingwen Chi +6
Propylene oxide is a major industrial chemical whose production currently relies on hazardous chlorine- or peroxide-based oxidants. Direct electrochemical epoxidation using water a…
Multi-AI Agent Framework Reveals the "Oxide Gatekeeper" in Aluminum Nanoparticle Oxidation
Yiming Lu, Tingyu Lu, Di Zhang +2
Aluminum nanoparticles (ANPs) are among the most energy-dense solid fuels, yet the atomic mechanisms governing their transition from passivated particles to explosive reactants rem…
The Key Steps and Distinct Performance Trends of Pyrrolic vs. Pyridinic M-N-C Catalysts in Electrocatalytic Nitrate Reduction
Qiuling Jiang, Mingyao Gu, Tianyi Wang +7
Electrochemical nitrate reduction reaction(NO3RR)offers a sustainable route for ambient ammonia synthesis. While metal-nitrogen-carbon (M-N-C) single-atom catalysts have emerged as…
Picturing the Gap Between the Performance and US-DOE's Hydrogen Storage Target: A Data-Driven Model for MgH2 Dehydrogenation
Chaoqun Li, Weijie Yang, Hao Liu +5
Developing solid-state hydrogen storage materials is as pressing as ever, which requires a comprehensive understanding of the dehydrogenation chemistry of a solid-state hydride. Tr…
Light-driven C-H bond activation mediated by 2D transition metal dichalcogenides
Jingang Li, Di Zhang, Zhongyuan Guo +17
C-H bond activation enables the facile synthesis of new chemicals. While C-H activation in short-chain alkanes has been widely investigated, it remains largely unexplored for long-…