The coordination environment of M-N-C catalysts play a crucial role in defining the structure–activity relationship and electrocatalytic behavior of these materials. This study …

2020年9月22日 · Herein, we propose a strategy by controlling the hydrogen spillover distance to in situ tune the electronic structure. The strategy is demonstrated to be feasible with the …

2024年3月28日 · In this context, an in-depth investigation of the electronic structure of catalysts, including valence state, electronic density, energy level, orbital shape, and electron spin, …

2023年10月1日 · Modifying the electronic structure can facilitate charge transfer processes or create efficient active sites with low reaction energy barriers, both of which are beneficial for …

2023年2月13日 · Controlling the electronic structure of transition-metal single-atom heterogeneous catalysts (SACs) is crucial to unlocking their full potential. The ability to do this …

2024年12月3日 · Electronic structures play a key role in the activities of supported metal catalysts. In this work, by using the ab initio molecular dynamics simulations and density functional …

2025年1月9日 · (A) Modulating the electronic structure of pre-catalysts to control surface reconstruction. Schemes of the relationship between spinel pre-catalyst structure and …

2023年4月29日 · Inter-site interaction in densely populated single-atom catalysts has been demonstrated to have a crucial role in regulating the electronic structure of metal atoms, and …

2021年2月18日 · In this Review, we summarize and compare the structural evolution of solid thermal catalysts, electrocatalysts and photocatalysts. We suggest that well-established …

2024年8月15日 · Modulating the electronic structure of catalysts to effectively couple the hydrogen evolution reaction (HER) and oxygen evolution reaction (OER) is essential for …