Accurate adsorption energies of small molecules on oxide surfaces: CO–MgO(001)
Author:
Publisher
Royal Society of Chemistry (RSC)
Subject
Physical and Theoretical Chemistry,General Physics and Astronomy
Link
http://pubs.rsc.org/en/content/articlepdf/2013/CP/C3CP52321G
Reference50 articles.
1. Semiempirical GGA-type density functional constructed with a long-range dispersion correction
2. Accurate Molecular Van Der Waals Interactions from Ground-State Electron Density and Free-Atom Reference Data
3. First-principles approach to rotational-vibrational frequencies and infrared intensity forH2adsorbed in nanoporous materials
4. Periodic local MP2 method for the study of electronic correlation in crystals: Theory and preliminary applications
Cited by 66 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. Preparation of Activated Carbon Nanostructured Al@CuO with Low Static Sensitivity and High Reactivity;ACS Omega;2024-03-28
2. Level-Shifted Embedded Cluster Method for Modeling the Chemistry of Metal Oxides;Journal of Chemical Theory and Computation;2024-02-01
3. CO adsorption on Pt(111) studied by periodic coupled cluster theory;Faraday Discussions;2024
4. Adsorption and vibrational spectroscopy of CO on the surface of MgO from periodic local coupled-cluster theory;Faraday Discussions;2024
5. State-of-the-art local correlation methods enable affordable gold standard quantum chemistry for up to hundreds of atoms;Chemical Science;2024
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