Reduced dimensionality quantum dynamics of the polyatomic reaction CH3 + CH4 -> CH4 + CH3 on an ab initio surface
Autors principals: | Remmert, S, Banks, S, Clary, D |
---|---|
Format: | Journal article |
Publicat: |
2009
|
Ítems similars
-
Reduced dimensionality quantum dynamics of CH3 + CH4 --> CH4 + CH3: symmetric hydrogen exchange on an Ab initio potential.
per: Remmert, S, et al.
Publicat: (2009) -
Reduced dimensionality quantum dynamics of Cl + CH4 --> HCl + CH3 on an ab initio potential.
per: Banks, S, et al.
Publicat: (2007) -
Reduced dimensionality spin-orbit dynamics of CH3 + HCl ⇌ CH4 + Cl on ab initio surfaces.
per: Remmert, S, et al.
Publicat: (2011) -
An improved treatment of spectator mode vibrations in reduced dimensional quantum dynamics: application to the hydrogen abstraction reactions mu + CH4, H + CH4, D + CH4, and CH3 + CH4.
per: Banks, S, et al.
Publicat: (2009) -
Ab initio rate constants from hyperspherical quantum scattering: application to H + CH4 --> H2 + CH3.
per: Kerkeni, B, et al.
Publicat: (2004)