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A combined experimental and computational investigation of the microscopic external heavy atom effect in van der Waals clusters
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UNSPECIFIED (2004) A combined experimental and computational investigation of the microscopic external heavy atom effect in van der Waals clusters. JOURNAL OF CHEMICAL PHYSICS, 121 (2). pp. 835-840. doi:10.1063/1.1759313 ISSN 0021-9606.
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Official URL: http://dx.doi.org/10.1063/1.1759313
Abstract
We present a combined experimental and computational study of the external heavy atom effect in van der Waals clusters of para-difluorobenzene (pDFB) with rare-gas atoms. Experimentally, clustering with rare-gas atoms is observed to shorten significantly the S-1 fluorescence lifetime compared with that of the pDFB monomer, an effect we interpret in terms of an enhancement of the S-1-T-1 intersystem crossing rate. In order to test the validity of this widely held assumption, we have calculated the S-1-T-1 spin-orbit coupling matrix elements in the X-pDFB complexes (X=Ne,Ar,Kr) using a multiconfigurational linear response approach. (C) 2004 American Institute of Physics.
Item Type: | Journal Article | ||||
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Subjects: | Q Science > QC Physics | ||||
Journal or Publication Title: | JOURNAL OF CHEMICAL PHYSICS | ||||
Publisher: | AMER INST PHYSICS | ||||
ISSN: | 0021-9606 | ||||
Official Date: | 8 July 2004 | ||||
Dates: |
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Volume: | 121 | ||||
Number: | 2 | ||||
Number of Pages: | 6 | ||||
Page Range: | pp. 835-840 | ||||
DOI: | 10.1063/1.1759313 | ||||
Publication Status: | Published |
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