Statistical theory for the kinetics and dynamics of roaming reactions.
about
Roaming dynamics in ion-molecule reactions: phase space reaction pathways and geometrical interpretation.The energy dependence of CO(v,J) produced from H2CO via the transition state, roaming, and triple fragmentation channels.Perspective: chemical dynamics simulations of non-statistical reaction dynamics.Crossing the dividing surface of transition state theory. II. Recrossing times for the atom-diatom interaction.What is special about how roaming chemical reactions traverse their potential surfaces? Differences in geodesic paths between roaming and non-roaming events.Theories and simulations of roaming.Communication: full dimensional quantum rate coefficients and kinetic isotope effects from ring polymer molecular dynamics for a seven-atom reaction OH + CH4 → CH3 + H2O.Complete active space second order perturbation theory (CASPT2) study of N(²D) + H₂O reaction paths on D₁ and D₀ potential energy surfaces: direct and roaming pathways.
P2860
Q35142532-0A81E283-A7F3-4BDA-B563-54714EF4F3B1Q38688484-8A141382-AAB3-422A-872B-663597DCC63BQ39188791-0FABE40D-E756-41AB-AA90-207970A0A720Q39213725-1F8EB306-7874-4626-A311-CFD3A73F013FQ48305096-FEB92316-A0FD-4C78-B4AD-5FE55CBCCE9DQ49590171-7C927B5A-E7A8-428D-BA16-F12878FC1C96Q50478711-7DFB1A92-9CF2-428F-A7E1-F88727E0B66DQ51040495-C113BB29-FE4C-4E13-B282-A52EA2C83814
P2860
Statistical theory for the kinetics and dynamics of roaming reactions.
description
2011 nî lūn-bûn
@nan
2011年の論文
@ja
2011年学术文章
@wuu
2011年学术文章
@zh-cn
2011年学术文章
@zh-hans
2011年学术文章
@zh-my
2011年学术文章
@zh-sg
2011年學術文章
@yue
2011年學術文章
@zh
2011年學術文章
@zh-hant
name
Statistical theory for the kinetics and dynamics of roaming reactions.
@en
Statistical theory for the kinetics and dynamics of roaming reactions.
@nl
type
label
Statistical theory for the kinetics and dynamics of roaming reactions.
@en
Statistical theory for the kinetics and dynamics of roaming reactions.
@nl
prefLabel
Statistical theory for the kinetics and dynamics of roaming reactions.
@en
Statistical theory for the kinetics and dynamics of roaming reactions.
@nl
P356
P1476
Statistical theory for the kinetics and dynamics of roaming reactions.
@en
P2093
Lawrence B Harding
Yuri Georgievskii
P304
14370-14381
P356
10.1021/JP208347J
P407
P577
2011-11-28T00:00:00Z