Correlation effects in the valence ionization spectra of large conjugated molecules: p-Benzoquinone, anthracenequinone and pentacenequinone

Journal of Electron Spectroscopy and Related Phenomena

Volumn 178-179, Issue C, 2010, Pages 61-79

  Knippenberg, S ^a,b   Deleuze, M S ^b  

^a GOETHE UNIVERSITY   (Germany)

^b HASSELT UNIVERSITY   (Belgium)

Author keywords

Chemical accuracy; Conjugated molecules; Electronic correlation and relaxation; Excited states; Low band gap systems; Polycyclic aromatic hydrocarbons; Shake ups

Indexed keywords

CONJUGATED MOLECULES; ELECTRONIC CORRELATION; ELECTRONIC CORRELATION AND RELAXATION; LOW BAND GAP; LOW BAND GAP SYSTEMS;

DENSITY FUNCTIONAL THEORY; ELECTRONS; ENERGY GAP; EXCITED STATES; GREEN'S FUNCTION; IONIZATION; MOLECULES; ORGANIC COMPOUNDS; PARTICLE DETECTORS; POLYCYCLIC AROMATIC HYDROCARBONS;

AROMATIC HYDROCARBONS;

EID: 77951023145     PISSN: 03682048     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.elspec.2009.04.013     Document Type: Article

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