Evaluation of Spartan semi-empirical molecular modeling software for calculations of molecules on surfaces: CO adsorption on Ni(111)
Author:
Publisher
Elsevier BV
Subject
General Chemical Engineering,Applied Microbiology and Biotechnology,Biotechnology
Reference20 articles.
1. The effect of potassium on the molecular orientation of CO chemisorbed on Ni(111): An esdiad study
2. Threefold-coordinated hollow adsorption site for Ni(111)-c(4×2)-CO: A surface-extended x-ray-absorption fine-structure study
3. Co stretching vibration of carbon monoxide adsorbed on nickel(111) studied by high resolution electron loss spectroscopy
4. Vibrational EELS studies of CO chemisorption on clean and carbided (111), (100) and (110) nickel surfaces
5. The adsorption sites of CO on Ni(111) as determined by infrared reflection-absorption spectroscopy
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. New Zn(II) diaqua complex with pivalic acid: Synthesis, characterization, DFT calculations, photoluminescence and photocatalytic properties;Journal of Molecular Structure;2025-01
2. Some “Special” Topics: (8.1) Solvation, (8.2) Singlet Diradicals, and (8.3) a Note on Heavy Atoms and Transition Metals;Computational Chemistry;2024
3. Semiempirical Calculations;Computational Chemistry;2024
4. Development of QSRR model of a set of Polycyclic Aromatic Hydrocarbons (PAHs) using simple regression analysis in silico;Asian Journal of Research in Chemistry;2023-10-31
5. Study of adsorption interactions between nitrous oxide and Zeolitic Imidazolate framework-8 (ZIF-8) by molecular modeling;Catalysis Today;2020-08
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