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Molecular Structure, HOMO-LUMO, MEP and Fukui Function Analysis of Some TTF-donor Substituted Molecules Using DFT (B3LYP) Calculations

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https://hal-normandie-univ.archives-ouvertes.fr/hal-01847972
Contributor : Jocelyne Levillain <>
Submitted on : Tuesday, July 24, 2018 - 10:59:40 AM
Last modification on : Thursday, July 2, 2020 - 3:21:32 AM

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  • HAL Id : hal-01847972, version 1

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A. Bendjeddou, T. Abbaz, A. Gouasmia, D. Villemin. Molecular Structure, HOMO-LUMO, MEP and Fukui Function Analysis of Some TTF-donor Substituted Molecules Using DFT (B3LYP) Calculations. Inter. Res. J. Pure & Appl. Chem., 2016, 12 (1), pp.1-9. ⟨hal-01847972⟩

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