Evaluating the impact of structural and rotational isomerization, as well as halogenation, on Y18 and Y18-ID small molecule acceptors: A DFT and TD-DFT study

Cisneros-García, Z.N.; Guirado-López, R.A.; Rodríguez-Zavala, J.G.; Facio-Muñoz, J.G.

doi:10.1016/j.comptc.2024.114581

Computational and Theoretical Chemistry

2024

DOI: 10.1016/j.comptc.2024.114581

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Evaluating the impact of structural and rotational isomerization, as well as halogenation, on Y18 and Y18-ID small molecule acceptors: A DFT and TD-DFT study

Z.N. Cisneros-García,

R.A. Guirado-López,

J.G. Rodríguez-Zavala

et al.

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A comprehensive study on the halogenation effect of non-fullerene acceptors for photovoltaic application

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Ma,

et al. 2024

Mater. Chem. Front.

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A comprehensive study on the halogenation effect of non-fullerene acceptors for photovoltaic application

Peng,

Ma,

et al. 2024

Mater. Chem. Front.

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show abstract

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Evaluating the impact of structural and rotational isomerization, as well as halogenation, on Y18 and Y18-ID small molecule acceptors: A DFT and TD-DFT study

Cited by 1 publication

References 74 publications

A comprehensive study on the halogenation effect of non-fullerene acceptors for photovoltaic application

A comprehensive study on the halogenation effect of non-fullerene acceptors for photovoltaic application

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