Reaction rate calculation for dissipative systems using invariant manifolds

Revuelta Peña, Fabio and Bartsch, Thomas and Benito Zafrilla, Rosa Maria and Borondo Rodríguez, Florentino (2013). Reaction rate calculation for dissipative systems using invariant manifolds. In: "XXXIII Dynamics Days Europe", 03/06/2013-07/06/2013, Madrid, España. ISBN 9788415302438. p. 1.

Description

Title: Reaction rate calculation for dissipative systems using invariant manifolds
Author/s:
  • Revuelta Peña, Fabio
  • Bartsch, Thomas
  • Benito Zafrilla, Rosa Maria
  • Borondo Rodríguez, Florentino
Item Type: Presentation at Congress or Conference (Poster)
Event Title: XXXIII Dynamics Days Europe
Event Dates: 03/06/2013-07/06/2013
Event Location: Madrid, España
Title of Book: XXXIII Dynamics Days Europe. Book of Abstracts
Date: July 2013
ISBN: 9788415302438
Subjects:
Faculty: E.T.S. de Ingeniería Agronómica, Alimentaria y de Biosistemas (UPM)
Department: Otro
Creative Commons Licenses: Recognition - No derivative works - Non commercial

Full text

[img]
Preview
PDF - Requires a PDF viewer, such as GSview, Xpdf or Adobe Acrobat Reader
Download (488kB) | Preview

Abstract

In this communication, we report on a new method that allows the identification of reactive trajectories exactly in anharmonic systems that interact with their environments without the need of any computationally costly numerical simulation. The method is based on the existence of geometrical structures (invariant manifolds) that act as separatrices of phase space. Further, we have succeeded in computing exact reaction rates; this has allowed us to calculate analytic corrections to the famous Kramer's formula due to the nonlinearities of the system.

More information

Item ID: 62387
DC Identifier: http://oa.upm.es/62387/
OAI Identifier: oai:oa.upm.es:62387
Deposited by: Memoria Investigacion
Deposited on: 26 Mar 2020 15:45
Last Modified: 27 Mar 2020 12:17
  • Logo InvestigaM (UPM)
  • Logo GEOUP4
  • Logo Open Access
  • Open Access
  • Logo Sherpa/Romeo
    Check whether the anglo-saxon journal in which you have published an article allows you to also publish it under open access.
  • Logo Dulcinea
    Check whether the spanish journal in which you have published an article allows you to also publish it under open access.
  • Logo de Recolecta
  • Logo del Observatorio I+D+i UPM
  • Logo de OpenCourseWare UPM