研究论文
Accelerating the development of electrocatalysts for electrochemical nitrogen fixation through theoretical and computational approaches
Shuyue Wang, Chao Qian, Shaodong Zhou
Zhejiang University
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摘要与影响
摘要 · 完整
Theoretical and computational methods of NRR catalysts at different scales.
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学术脉络
学科主题
材料 / 化学Ammonia Synthesis and Nitrogen Reduction
Electrocatalysts for Energy Conversion · CO2 Reduction Techniques and Catalysts
参考文献 165
Transition Metal Nitride Catalysts for Electrochemical Reduction of Nitrogen to Ammonia at Ambient Conditions
被引 64Younes Abghoui, Egill Skúlason · Procedia Computer Science · 2015
Synthesis of ammonia directly from air and water at ambient temperature and pressure
被引 416Rong Lan, John T. S. Irvine, Shanwen Tao · Scientific Reports · 2013
A theoretical evaluation of possible transition metal electro-catalysts for N 2 reduction
被引 1,616Egill Skúlason, Thomas Bligaard, Sigríður Guðmundsdóttir · Physical Chemistry Chemical Physics · 2011
此处列出前 3 条
引用本文 11
Electrocatalytic reduction of nitrogen to ammonia on metal nanoclusters: insights and trends from d- and p-block metals
被引 14Rajesh K. Raju · Physical Chemistry Chemical Physics · 2025
The first principles study of the dual-atom catalyst based on g-C3N5 for efficient nitrogen fixation
被引 10Tianbao Wu, Xueping Fan, Chao Wang · Applied Surface Science · 2024
Theoretical Study on the Nitrogen Reduction Reaction (NRR) on Cu Oxide-Based Electrocatalysts
被引 7Stefanie E. Bogenrieder, Hepsibah Priyadarshini Christopher, Julian Beßner · The Journal of Physical Chemistry C · 2025
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