Exploration of Nonlinear Optical Properties for the First Theoretical Framework of Non-Fullerene DTS(FBTTh2)2-Based Derivatives
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DOI: 10.1021/acsomega.2c01474
Abstract: Organic compounds having significant nonlinear optical (NLO) applications are being employed in the optoelectronics field. In the current work, a series of non-fullerene acceptor (NFA) based compounds are designed by modifying the acceptors with different… read more here.
Keywords: dts fbtth2; nonlinear optical; non fullerene; exploration nonlinear ... See more keywords
Unraveling the NLO potential of isoquinoline functionalized chromophores via molecular modeling using DFT/TD-DFT approaches
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DOI: 10.1038/s41598-025-04911-7
Abstract: The main focused of this work is the designing of isoquinoline-based derivatives through structural modeling of synthesized compound (BPDI). Two distinct series of derivatives were developed: MPBID1–MPBID6, in which electron-withdrawing groups were introduced at unfused… read more here.
Keywords: unraveling nlo; isoquinoline; designed compounds; dft dft ... See more keywords