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Dispersed fluorescence spectra of chlorobenzene

Authors :
Petra Imhof
Karl Kleinermanns
Source :
Chemical Physics. 270:227-236
Publication Year :
2001
Publisher :
Elsevier BV, 2001.

Abstract

The vibronic spectra of the S 0 and S 1 state of chlorobenzene have been analyzed via laser induced fluorescence spectroscopy. The ground state frequencies were determined by dispersed fluorescence and comparison with ab initio calculations on the MP2 and B3LYP (6-311G(d,p)) level. Additional complete active space self-consistent field calculations (6-311G++(d,p)) have been carried out for theoretical description of the S 1 state.

Details

ISSN :
03010104
Volume :
270
Database :
OpenAIRE
Journal :
Chemical Physics
Accession number :
edsair.doi...........ec594e4a3bfd34d9b4bd98fba1ae4c0c
Full Text :
https://doi.org/10.1016/s0301-0104(01)00397-4