Memorias de investigación
Communications at congresses:
Reaction rate calculation with invariant manifolds
Year:2015

Research Areas
  • Physics chemical and mathematical

Information
Abstract
The usual identification of reactive trajectories for the calculation of reaction rates requires very time-demanding simulations, particularly if the environment presents memory effects. In this work, we develop a new method that permits the identification of reactive trajectories in a system under the action of a stochastic colored driving. This method is based on the perturbative computation of the invariant structures that act as separatrices for reactivity. Furthermore, using this perturbative scheme, we have obtained a formally exact expression for the reaction rate in multidimensional systems coupled to colored noisy environments. We also report some results on white noise.
International
Si
Congress
ILluminyating 2015 - Transition States for Multielectron Ionization Phenomena [http://www.trans-mi.eu/news/illuminyating2015] [http://www.gsc.upm.es/illuminyating2015/]
960
Place
Madrid
Reviewers
Si
ISBN/ISSN
0000-0000
Start Date
07/05/2015
End Date
08/05/2015
From page
34
To page
34
Book of abstracts of ILluminyating 2015
Participants

Research Group, Departaments and Institutes related
  • Creador: Grupo de Investigación: Grupo de Sistemas Complejos
  • Departamento: Ingeniería Agroforestal