Advanced science (Weinheim, Baden-Wurttemberg, Germany)
Computation-Guided Dual-Site Electrocatalysts for Record-Performance Nitrite-to-Ammonia Conversion.
Hui Zhang, Haiyan Duan, Donglin Han, Zhenlin Wang, Xingchi Li, Dengchao Peng, Lupeng Han, Tianting Pang, Evangelina Pensa, Wenqiang Qu, Yongjie Shen, Haotian Wang, Wei Ren, Ming Xie, Emiliano Cortés
Published: 202510.1002/advs.202520683
Abstract
Designing catalysts that can simultaneously accelerate reactant activation and hydrogenation remains a central challenge in electrochemical ammonia synthesis. Here, a computation-guided, dual-site electrocatalyst design strategy that bridges first-pr…
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