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Impact of doping with organic dopants and mixed doping with alkali metals and organic dopants on the absorption, electronic, optoelectronic, thermodynamic and nonlinear optical properties of dibenzo[b,def]chrysene in gaseous media: DFT and TD-DFT studies.
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- Journal of Molecular Modeling, 2024, v. 30, n. 8, p. 1, doi. 10.1007/s00894-024-06026-8
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Theoretical investigations of the electronic structure, spectroscopic (IR, Raman and UV–Vis), optoelectronic, thermodynamic and nonlinear optical properties of chromophores of 2-styrylquinoline and 2-(3-nitrostyryl)quinoline.
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- Optical & Quantum Electronics, 2023, v. 55, n. 14, p. 1, doi. 10.1007/s11082-023-05495-0
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Influence of lithium doping on optoelectronic, electronic, reactivity descriptors, thermodynamic and nonlinear optical properties of dibenzo[b,def]chrysene: insight by a DFT study.
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- Optical & Quantum Electronics, 2023, v. 55, n. 11, p. 1, doi. 10.1007/s11082-023-05294-7
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- Article