New Potential Energy Function for Four-Atom Reactions. Application to OH + H2
Author:
Affiliation:
1. Department of Chemistry, University College London, 20 Gordon Street, WC1H 0AJ London, U.K.
Publisher
American Chemical Society (ACS)
Subject
Physical and Theoretical Chemistry
Link
https://pubs.acs.org/doi/pdf/10.1021/jp982433i
Reference29 articles.
1. Electronic structure computations and theoretical chemical kinetics: developments at the interface
2. Multiproperty determination of a new N2–Ar intermolecular interaction potential energy surface
3. Molecular potential energy surfaces by interpolation
4. An interpolated unrestricted Hartree–Fock potential energy surface for the OH+H2→H2O+H reaction
5. Distributed approximating functional approach to fitting multi-dimensional surfaces
Cited by 102 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. High vibrational excitation of the reagent transforms the late-barrier H + HOD reaction into an early-barrier reaction;The Journal of Chemical Physics;2024-01-24
2. Chemical laser based on polyatomic chemical reaction dynamics;XXIII International Symposium on High Power Laser Systems and Applications;2022-11-07
3. Vibrational and Rotational Gaussian Binning selections on QCT calculations for the OH + D2 → HOD((vHO’, vHOD’, vOD’), J’) + D reaction;Chemical Physics;2021-11
4. Rethinking the description of water product in polyatomic OH/OD + XH (X ≡ D, Br, NH2 and GeH3) reactions: theory/experimental comparison;Theoretical Chemistry Accounts;2020-03
5. Highly Accurately Fitted Potential Energy Surfaces for Polyatomic Reactive Systems;Acta Physico-Chimica Sinica;2019
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