Interpolated variational transition state theory and tunneling calculations of the rate constant of the reaction OH+CH4 at 223–2400 K
about
Ab initio based potential energy surface and kinetics study of the OH + NH3 hydrogen abstraction reaction.Six-dimensional and seven-dimensional quantum dynamics study of the OH + CH4 → H2O + CH3 reaction.Communication: full dimensional quantum rate coefficients and kinetic isotope effects from ring polymer molecular dynamics for a seven-atom reaction OH + CH4 → CH3 + H2O.Mode specificity in the OH + CHD3 reaction: Reduced-dimensional quantum and quasi-classical studies on an ab initio based full-dimensional potential energy surface.Effects of reactant rotation on the dynamics of the OH + CH4 → H2O + CH3 reaction: a six-dimensional study.Predicting tropospheric degradation of chemicals: from estimation to computation.Negative collision energy dependence of Br formation in the OH + HBr reaction.Role of conformational structures and torsional anharmonicity in controlling chemical reaction rates and relative yields: butanal + HO2reactionsA product branching ratio controlled by vibrational adiabaticity and variational effects: Kinetics of the H + trans-N2H2 reactions
P2860
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P2860
Interpolated variational transition state theory and tunneling calculations of the rate constant of the reaction OH+CH4 at 223–2400 K
description
im Juli 1993 veröffentlichter wissenschaftlicher Artikel
@de
wetenschappelijk artikel
@nl
наукова стаття, опублікована в липні 1993
@uk
name
Interpolated variational trans ...... reaction OH+CH4 at 223–2400 K
@en
Interpolated variational trans ...... reaction OH+CH4 at 223–2400 K
@nl
type
label
Interpolated variational trans ...... reaction OH+CH4 at 223–2400 K
@en
Interpolated variational trans ...... reaction OH+CH4 at 223–2400 K
@nl
prefLabel
Interpolated variational trans ...... reaction OH+CH4 at 223–2400 K
@en
Interpolated variational trans ...... reaction OH+CH4 at 223–2400 K
@nl
P2860
P356
P1476
Interpolated variational trans ...... reaction OH+CH4 at 223–2400 K
@en
P2093
Vasilios S. Melissas
P2860
P304
P356
10.1063/1.465401
P407
P577
1993-07-15T00:00:00Z