Comparisons of classical chemical dynamics simulations of the unimolecular decomposition of classical and quantum microcanonical ensembles
Author:
Funder
National Science Foundation
Publisher
AIP Publishing
Subject
Physical and Theoretical Chemistry,General Physics and Astronomy
Link
http://aip.scitation.org/doi/pdf/10.1063/1.4714219
Reference83 articles.
1. Monte Carlo Calculation of Triatomic Dissociation Rates. I. N2O and O3
2. Monte Carlo Calculations. IV. Further Studies of Unimolecular Dissociation
3. On non‐RRKM unimolecular kinetics: Molecules in general, and CH3NC in particular
4. Nonlinear resonances and vibrational energy flow in model hydrocarbon chains
5. The heavy‐atom effect in intramolecular vibrational energy transfera)
Cited by 14 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. Direct Dynamics Simulations of the Unimolecular Decomposition of the Randomly Excited 1CH2O2 Criegee Intermediate. Comparison with 3CH2 + 3O2 Reaction Dynamics;The Journal of Physical Chemistry A;2020-02-05
2. A Competition between Dissociation Pathway and Energy Transfer Pathway: Unimolecular Dissociation of a Benzene–Hexafluorobenzene Complex in Nitrogen Bath;The Journal of Physical Chemistry A;2019-11-22
3. Is CH3NC isomerization an intrinsic non-RRKM unimolecular reaction?;The Journal of Chemical Physics;2019-11-14
4. Anharmonic Densities of States for Vibrationally Excited I–(H2O), (H2O)2, and I–(H2O)2;Journal of Chemical Theory and Computation;2018-06-26
5. Effects of vibrational and rotational energies on the lifetime of the pre-reaction complex for the F−+ CH3I SN2 reaction;International Journal of Mass Spectrometry;2018-06
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