Computational design of quadrupolar donor-acceptor-donor molecules with near-infrared light-harvesting capabilities
Sign Up to like & getrecommendations! Published in 2018 at "Dyes and Pigments"
DOI: 10.1016/j.dyepig.2017.12.003
Abstract: Abstract The electronic and optical properties of a large series of symmetrical D–π–A–π–D chromophores are investigated. Vertical transition energies and related wavelengths, as well as absorption strengths, are computed by means of density functional theory… read more here.
Keywords: computational design; near infrared; design quadrupolar; donor ... See more keywords