Theoretical study of the excited state properties of luminescent phospholes
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DOI: 10.1016/j.dyepig.2019.01.040
Abstract: Abstract TD-DFT calculations with the use of hybrid PBE0 functional and def-TZVP Alrich's basis set are shown to provide an excellent cost-effective computational approach for the treatment of the excited states of phospholes. The general… read more here.
Keywords: theoretical study; excited state; luminescent phospholes; study excited ... See more keywords