The total angular momentum (J =1,10) S matrix elements of the Li+HF reaction have been calculated using a time independent method, and matrix transformed to the stereodirected and Gauss Legendre discrete variable representations.This paper extends to higher partial waves the study on the stereodynamics of the Li+HF reaction performed at a total angular momentum J =0. The work is focused on the orbital angular momentum (L) substates rather than on the projections K on the intermolecular axis and emphasis is given to a space-fixed rather than to a body-fixed view of the collision process. A detailed comparison of stereodirected and discrete variable representations is also made.

Correlation of attack and recoil angles for the Li +HF reaction : an exact quantum mechanical study at low and high total angular momentum

Skouteris, Dimitrios
;
2008

Abstract

The total angular momentum (J =1,10) S matrix elements of the Li+HF reaction have been calculated using a time independent method, and matrix transformed to the stereodirected and Gauss Legendre discrete variable representations.This paper extends to higher partial waves the study on the stereodynamics of the Li+HF reaction performed at a total angular momentum J =0. The work is focused on the orbital angular momentum (L) substates rather than on the projections K on the intermolecular axis and emphasis is given to a space-fixed rather than to a body-fixed view of the collision process. A detailed comparison of stereodirected and discrete variable representations is also made.
2008
Settore CHIM/02 - Chimica Fisica
Stereodynamics; stereodirected; DVR; reaction; Li plus HF; probability; discrete variable representations
File in questo prodotto:
File Dimensione Formato  
2008CP-Li+HF.pdf

Accesso chiuso

Descrizione: Articolo principale
Tipologia: Published version
Licenza: Non pubblico
Dimensione 406.71 kB
Formato Adobe PDF
406.71 kB Adobe PDF   Richiedi una copia

I documenti in IRIS sono protetti da copyright e tutti i diritti sono riservati, salvo diversa indicazione.

Utilizza questo identificativo per citare o creare un link a questo documento: https://hdl.handle.net/11384/13411
Citazioni
  • ???jsp.display-item.citation.pmc??? ND
  • Scopus 13
  • ???jsp.display-item.citation.isi??? 13
social impact