Activity, Selectivity, and Durability of Ruthenium Nanoparticle Catalysts for Ammonia Synthesis by Reactive Molecular Dynamics Simulation: The Size Effect
Author:
Affiliation:
1. Computational Science Research Center, Korea Institute of Science and Technology (KIST), 5 Hwarangno 14-gil, Seongbuk-gu, Seoul 02792, Republic of Korea
Funder
Korea Institute of Science and Technology
National Research Foundation
Publisher
American Chemical Society (ACS)
Subject
General Materials Science
Link
https://pubs.acs.org/doi/pdf/10.1021/acsami.8b05070
Reference38 articles.
1. Ammonia synthesis catalyst 100 years: Practice, enlightenment and challenge
2. Electronic factors in catalysis
3. Ruthenium Nanocatalysts for Ammonia Synthesis: A Review
4. The influence of crystallite size on the adsorption of molecular nitrogen on nickel, palladium and platinum
5. Dissociative adsorption of N on ru(0001): A surface reaction totally dominated by steps
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