Are vinyl coupled furan derivatives better than vinyl coupled thiophene derivatives for optoelectronic applications? – Answers from DFT/TDDFT calculations
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DOI: 10.1016/j.commatsci.2019.02.015
Abstract: Abstract In the present study, twenty three new vinyl coupled furan oligomers (VCFOs) and four already reported thiophene oligomer (VCTOs) have been investigated for potential optoelectronic properties using DFT/TDDFT calculations. Frontier molecular orbital analysis shows… read more here.
Keywords: coupled furan; tddft calculations; vinyl; dft tddft ... See more keywords