Study of the C(3P) + OH(X2Π) → CO(XΣg+) + H(2S) Reaction: A Fully Global ab Initio Potential Energy Surface of the XA‘ State
Author:
Affiliation:
1. Laboratoire PALMS, UMR CNRS 6627, Université de Rennes 1, Campus de Beaulieu, 35042 Rennes Cedex, France
2. Laboratoire LPM, UMR CNRS 6624, Université de Franche-Comté, Campus de la Bouloie, 16 route de Gray, 25030 Besançon Cedex, France
Publisher
American Chemical Society (ACS)
Subject
Physical and Theoretical Chemistry
Link
https://pubs.acs.org/doi/pdf/10.1021/jp064352p
Reference32 articles.
1. The unimolecular dissociation of HCO. II. Comparison of calculated resonance energies and widths with high‐resolution spectroscopic data
2. Ab initiostudy of the photodissociation of HCO in the first absorption band: Three-dimensional wave packet calculations including theX̃2A′−Ã2A″Renner–Teller coupling
3. The Renner-Teller-induced predissociation of HCO(Ã 2A′)
4. Ab initio calculations of electronic and vibrational energies of HCO and HOC
5. Potential energy functions for ground state surfaces of HCO and HNO
Cited by 48 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. The role of intersystem crossing in the reactive collision of S+(4S) with H2;The Journal of Chemical Physics;2024-07-22
2. Quantum study of the rovibrational relaxation of HF by collision with 4He on a new potential energy surface;Physical Chemistry Chemical Physics;2024
3. Dynamics of C(3P) + OH(X 2Π) reaction on the new global HCO(X2A′) potential energy surface;The Journal of Chemical Physics;2023-06-12
4. Accurate potential energy surfaces for the excited state of CF2 molecule;Chemical Physics;2020-10
5. Non-adiabatic quantum dynamics of the electronic quenching OH(A2Σ+) + Kr;Physical Chemistry Chemical Physics;2020
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