Optoelectronic properties of the newly designed 1,3,5-triazine derivatives with isatin, chalcone and acridone moieties
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DOI: 10.1016/j.comptc.2021.113160
Abstract: Abstract We have proposed the structures of three 1,3,5-triazine-2,4-diamine analogs and subjected them to density functional theory (DFT) calculations and molecular dynamics (MD) simulations to assess their potential for applications in the area of organic… read more here.
Keywords: newly designed; properties newly; acridone moieties; triazine derivatives ... See more keywords