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The excited states of azulene: A study of the vibrational energy levels for the lower ππ*-valence states by configuration interaction and density functional calculations, and theoretical studies of the Rydberg states.
Palmer, Michael H; Jones, Nykola C; Hoffmann, Søren Vrønning; Aitken, R Alan; Coreno, Marcello; de Simone, Monica; Grazioli, Cesare; Patterson, Iain L J.
Afiliação
  • Palmer MH; School of Chemistry, University of Edinburgh, Joseph Black Building, David Brewster Road, Edinburgh EH9 3FJ, Scotland, United Kingdom.
  • Jones NC; ISA, Department of Physics and Astronomy, Aarhus University, Ny Munkegade 120, DK-8000 Aarhus C, Denmark.
  • Hoffmann SV; ISA, Department of Physics and Astronomy, Aarhus University, Ny Munkegade 120, DK-8000 Aarhus C, Denmark.
  • Aitken RA; School of Chemistry, University of St Andrews, North Haugh, St. Andrews, Fife KY16 9ST, Scotland, United Kingdom.
  • Coreno M; ISM-CNR, Instituto di Struttura della Materia, LD2 Unit, 34149 Trieste, Italy.
  • de Simone M; IOM-CNR, Istituto Officina dei Materiali, Basovizza SS-14, Km 163.5, 34149 Trieste, Italy.
  • Grazioli C; IOM-CNR, Istituto Officina dei Materiali, Basovizza SS-14, Km 163.5, 34149 Trieste, Italy.
  • Patterson ILJ; School of Chemistry, University of St Andrews, North Haugh, St. Andrews, Fife KY16 9ST, Scotland, United Kingdom.
J Chem Phys ; 157(15): 154307, 2022 Oct 21.
Article em En | MEDLINE | ID: mdl-36272785
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Texto completo: 1 Coleções: 01-internacional Base de dados: MEDLINE Idioma: En Revista: J Chem Phys Ano de publicação: 2022 Tipo de documento: Article País de afiliação: Reino Unido
Texto completo
Adicionar na Minha BVS
Imprimir
XML
PubMed Links
Buscar no Google

Texto completo: 1 Coleções: 01-internacional Base de dados: MEDLINE Idioma: En Revista: J Chem Phys Ano de publicação: 2022 Tipo de documento: Article País de afiliação: Reino Unido