Toward a Specific Reaction Parameter Density Functional for H2 + Ni(111): Comparison of Theory with Molecular Beam Sticking Experiments
Author:
Affiliation:
1. Leiden Institute of Chemistry, Gorlaeus Laboratories, Leiden University, P.O. Box 9502, 2300 RA Leiden, The Netherlands
Funder
FP7 Ideas: European Research Council
Publisher
American Chemical Society (ACS)
Subject
Surfaces, Coatings and Films,Physical and Theoretical Chemistry,General Energy,Electronic, Optical and Magnetic Materials
Link
http://pubs.acs.org/doi/pdf/10.1021/acs.jpcc.9b05928
Reference84 articles.
1. Concepts of Modern Catalysis and Kinetics
2. Primary steps in catalytic synthesis of ammonia
3. Synthesizing our future
4. Chemically Accurate Simulation of a Prototypical Surface Reaction: H 2 Dissociation on Cu(111)
5. Toward a Database of Chemically Accurate Barrier Heights for Reactions of Molecules with Metal Surfaces
Cited by 15 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. Benchmarking of machine learning interatomic potentials for reactive hydrogen dynamics at metal surfaces;Machine Learning: Science and Technology;2024-07-15
2. Adsorption and vibrational spectroscopy of CO on the surface of MgO from periodic local coupled-cluster theory;Faraday Discussions;2024
3. Characterisation of magnetic atomic and molecular beamlines for the extraction of empirical scattering-matrices;Physical Chemistry Chemical Physics;2024
4. Constructing Mixed Density Functionals for Describing Dissociative Chemisorption on Metal Surfaces: Basic Principles;The Journal of Physical Chemistry A;2023-12-05
5. Machine Learning Interatomic Potentials for Reactive Hydrogen Dynamics at Metal Surfaces Based on Iterative Refinement of Reaction Probabilities;The Journal of Physical Chemistry C;2023-12-04
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