An experimental and theoretical study of the photoelectron spectra of <i>cis</i>-dichloroethene: Valence shell vertical ionization and vibronic coupling in the low-lying cationic states.

Trofimov, A B; Powis, I; Menzies, R C; Holland, D M P; Antonsson, E; Patanen, M; Nicolas, C; Miron, C; Skitnevskaya, A D; Gromov, E V; Köppel, H

An experimental and theoretical study of the photoelectron spectra of cis-dichloroethene: Valence shell vertical ionization and vibronic coupling in the low-lying cationic states.

Trofimov, A B; Powis, I; Menzies, R C; Holland, D M P; Antonsson, E; Patanen, M; Nicolas, C; Miron, C; Skitnevskaya, A D; Gromov, E V; Köppel, H.

Afiliación

Trofimov AB; Laboratory of Quantum Chemistry, Irkutsk State University, Karl Marx Str. 1, 664003 Irkutsk, Russia.
Powis I; School of Chemistry, University of Nottingham, Nottingham NG7 2RD, United Kingdom.
Menzies RC; School of Chemistry, University of Nottingham, Nottingham NG7 2RD, United Kingdom.
Holland DMP; Daresbury Laboratory, Daresbury, Warrington, Cheshire WA4 4AD, United Kingdom.
Antonsson E; Physical Chemistry, Freie Universität Berlin, Takustr. 3, D-14195 Berlin, Germany.
Patanen M; Nano and Molecular Systems Research Unit, Faculty of Science, University of Oulu, P.O. Box 3000, 90014 Oulu, Finland.
Nicolas C; Synchrotron SOLEIL, l'Orme des Merisiers, Saint-Aubin, BP 48, 91192 Gif-sur-Yvette, France.
Miron C; LIDYL, CEA, CNRS, Université Paris-Saclay, CEA Saclay, 91191 Gif-sur-Yvette, France.
Skitnevskaya AD; Laboratory of Quantum Chemistry, Irkutsk State University, Karl Marx Str. 1, 664003 Irkutsk, Russia.
Gromov EV; Theoretische Chemie, Physikalisch-Chemisches Institut, Universität Heidelberg, Im Neuenheimer Feld 229, 69120 Heidelberg, Germany.
Köppel H; Theoretische Chemie, Physikalisch-Chemisches Institut, Universität Heidelberg, Im Neuenheimer Feld 229, 69120 Heidelberg, Germany.

J Chem Phys ; 149(7): 074306, 2018 Aug 21.

Article en En | MEDLINE | ID: mdl-30134699

Asunto(s)

Dicloroetilenos/química; Dicloroetilenos/efectos de la radiación; Simulación por Computador; Electrones; Modelos Químicos; Modelos Moleculares; Espectroscopía de Fotoelectrones; Fotones; Distribución de Poisson; Estereoisomerismo; Vibración

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Texto completo: 1 Base de datos: MEDLINE Asunto principal: Dicloroetilenos Tipo de estudio: Prognostic_studies Idioma: En Revista: J Chem Phys Año: 2018 Tipo del documento: Article

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