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
Cited by 28 articles. 订阅此论文施引文献 订阅此论文施引文献,注册后可以免费订阅5篇论文的施引文献,订阅后可以查看论文全部施引文献
1. Quasi-classical Trajectory Calculation of Rate Constants Using Ab-initio Trained Machine Learning Force Field (aML-MD);AIAA SCITECH 2024 Forum;2024-01-04
2. A review of multiscale modelling approaches for understanding catalytic ammonia synthesis and decomposition;Journal of Catalysis;2024-01
3. Molecular dynamics for electrocatalysis: Mechanism explanation and performance prediction;Energy Reviews;2023-09
4. Investigation on the effect of water addition on benzene oxidation over palladium-oxide nanoparticle via ReaxFF molecular dynamics;International Journal of Hydrogen Energy;2023-03
5. Plasma Fluorinated Nano-SiO2 Enhances the Surface Insulation Performance of Glass Fiber Reinforced Polymer;Nanomaterials;2023-02-28
1.学者识别学者识别
2.学术分析学术分析
3.人才评估人才评估
"同舟云学术"是以全球学者为主线,采集、加工和组织学术论文而形成的新型学术文献查询和分析系统,可以对全球学者进行文献检索和人才价值评估。用户可以通过关注某些学科领域的顶尖人物而持续追踪该领域的学科进展和研究前沿。经过近期的数据扩容,当前同舟云学术共收录了国内外主流学术期刊6万余种,收集的期刊论文及会议论文总量共计约1.5亿篇,并以每天添加12000余篇中外论文的速度递增。我们也可以为用户提供个性化、定制化的学者数据。欢迎来电咨询!咨询电话:010-8811{复制后删除}0370
www.globalauthorid.com
TOP
Copyright © 2019-2024 北京同舟云网络信息技术有限公司 京公网安备11010802033243号 京ICP备18003416号-3