eprintid: 16206
rev_number: 28
userid: 1291
dir: disk0/00/01/62/06
datestamp: 2012-11-12 15:11:51
lastmod: 2021-06-12 22:55:22
status_changed: 2012-11-12 15:11:51
type: article
metadata_visibility: show
item_issues_count: 0
eprint_status: archive
creators_name: Falcetta, MF
creators_name: Choi, Y
creators_name: Jordan, KD
creators_email: 
creators_email: 
creators_email: jordan@pitt.edu
creators_id: 
creators_id: 
creators_id: JORDAN
title: Ab initio investigation of the temporary anion states of perfluoroethane
ispublished: pub
divisions: sch_as_chemistry
full_text_status: public
abstract: The stabilization method is used to characterize the temporary anion states of C2F6. Based on the theoretical results, we assign the lowest-energy feature in the electron transmission spectrum of C2F6 to the 2Eu groundstate anion and the second feature to overlapping 12Au, 12A1g, 22Au, and 12Eg anion states. It is also proposed that the bimodal kinetic energy distribution of the F- ions produced in the dissociative attachment of near 5 eV electrons on C2F6 is due to the Jahn-Teller effect. © 2000 American Chemical Society.
date: 2000-10-26
date_type: published
publication: Journal of Physical Chemistry A
volume: 104
number: 42
pagerange: 9605 - 9612
refereed: TRUE
issn: 1089-5639
centers: cen_other_molecularmatsim
id_number: 10.1021/jp001782l
citation:   Falcetta, MF and Choi, Y and Jordan, KD  (2000) Ab initio investigation of the temporary anion states of perfluoroethane.  Journal of Physical Chemistry A, 104 (42).  9605 - 9612.  ISSN 1089-5639     
document_url: http://d-scholarship-dev.library.pitt.edu/16206/1/licence.txt