Computational modeling of oligothiophenes‐based donor molecules to boost optoelectronic attributes of organic solar cells
Sign Up to like & getrecommendations! Published in 2024 at "Journal of the Chinese Chemical Society"
DOI: 10.1002/jccs.202400033
Abstract: The computational modeling of seven oligothiophene‐based donor molecules (TZ1–TZ7) designed by acceptor modification at the terminal position of the literature molecule (TZR) were discussed for organic solar cells (OSCs). DFT simulations using B3LYP/def2svp levels were performed… read more here.
Keywords: computational modeling; based donor; solar cells; tz1 tz7 ... See more keywords
Tuning the optoelectronic properties of triphenylamine (TPA) based small molecules by modifying central core for photovoltaic applications
Sign Up to like & getrecommendations! Published in 2021 at "Journal of Molecular Modeling"
DOI: 10.1007/s00894-021-04867-1
Abstract: Small donor molecules based on fused ring acceptors exhibit encouraging photovoltaic properties and expeditious advancement in organic solar cells. Central core modification of non-fullerene acceptor materials is a favorable methodology to enhance electronic properties and… read more here.
Keywords: donor molecules; molecules bdtm1; photovoltaic; central core ... See more keywords