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Title: Peroxyacetyl radical: Electronic excitation energies, fundamental vibrational frequencies, and symmetry breaking in the first excited state

Authors:
 [1] ;  [1] ;  [1] ;  [1] ;  [1]
  1. Center for Computational Quantum Chemistry, University of Georgia, Athens, Georgia 30602, USA
Publication Date:
OSTI Identifier:
1228508
Grant/Contract Number:
FG02-97- ER14748
Type:
Publisher's Accepted Manuscript
Journal Name:
The Journal of Chemical Physics
Additional Journal Information:
Journal Volume: 142; Journal Issue: 5; Journal ID: ISSN 0021-9606
Publisher:
American Institute of Physics
Sponsoring Org:
USDOE
Country of Publication:
United States
Language:
English