Resonant Auger spectra of the ethene molecule excited at energies across the C1s → π* energy band are reported. Our measurements address the unexpected variation of the intensity of the A state with respect to the other singly ionized valence states. An approach, based on group theory and calculations using Coulomb 4-center integrals, is proposed to explain the behaviour of the intensity of the ground state and excited states of the ion upon resonant excitation. The new method provides a calculationally inexpensive route to predict relative intensities of different resonant Auger bands in polyatomic molecules, without the need for an exhaustive knowledge of the potential energy surfaces of the electronic states involved.
Flammini, R., Satta, M., Oʼkeeffe, P., Coreno, M., Kivimäki, A., de Simone, M., et al. (2014). An experimental and theoretical study of the resonant Auger spectrum of the ethene molecule. NEW JOURNAL OF PHYSICS, 16, 73022 [doi:10.1088/1367-2630/16/7/073022].
An experimental and theoretical study of the resonant Auger spectrum of the ethene molecule
CARBONE, MARILENA;
2014-07-17
Abstract
Resonant Auger spectra of the ethene molecule excited at energies across the C1s → π* energy band are reported. Our measurements address the unexpected variation of the intensity of the A state with respect to the other singly ionized valence states. An approach, based on group theory and calculations using Coulomb 4-center integrals, is proposed to explain the behaviour of the intensity of the ground state and excited states of the ion upon resonant excitation. The new method provides a calculationally inexpensive route to predict relative intensities of different resonant Auger bands in polyatomic molecules, without the need for an exhaustive knowledge of the potential energy surfaces of the electronic states involved.File | Dimensione | Formato | |
---|---|---|---|
60 Ethylene New Journal of Physics 2014.pdf
accesso aperto
Dimensione
387.66 kB
Formato
Adobe PDF
|
387.66 kB | Adobe PDF | Visualizza/Apri |
I documenti in IRIS sono protetti da copyright e tutti i diritti sono riservati, salvo diversa indicazione.