Counter-propagating wave packets in the quantum transition state approach to reactive scattering
Author:
Affiliation:
1. Theoretische Chemie, Fakultät für Chemie, Universität Bielefeld, Universitätsstr. 25, D-33615 Bielefeld, Germany
Funder
Alexander von Humboldt-Stiftung
Publisher
AIP Publishing
Subject
Physical and Theoretical Chemistry,General Physics and Astronomy
Link
http://aip.scitation.org/doi/pdf/10.1063/1.5097997
Reference78 articles.
1. A seven-dimensional quantum study of the H+CH4 reaction
2. Ab initio potential energy surface and quantum dynamics for the H + CH4 → H2 + CH3 reaction
3. An eight-dimensional quantum mechanical Hamiltonian for X + YCZ3 system and its applications to H + CH4 reaction
4. Effects of reagent vibrational excitation on the dynamics of the H + CHD3 → H2 + CD3 reaction: A seven-dimensional time-dependent wave packet study
5. Depression of reactivity by the collision energy in the single barrier H + CD4 -> HD + CD3 reaction
Cited by 7 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. A non-hierarchical multi-layer multi-configurational time-dependent Hartree approach for quantum dynamics on general potential energy surfaces;The Journal of Chemical Physics;2024-06-13
2. Eigenstate calculation in the state-averaged (multi-layer) multi-configurational time-dependent Hartree approach;The Journal of Chemical Physics;2024-01-17
3. A numerically exact correlation discrete variable representation for multi-configurational time-dependent Hartree calculations;The Journal of Chemical Physics;2023-06-22
4. A non-hierarchical correlation discrete variable representation;The Journal of Chemical Physics;2022-04-07
5. Full-dimensional quantum dynamics study of isotope effects for the H2 + NH2/ND2/NHD and H2/D2/HD + NH2 reactions;The Journal of Chemical Physics;2021-02-21
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