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  1. 1
    C-PCM study of solvent influence on the ground and excited state structures of borazanaphthalene

    C-PCM study of solvent influence on the ground and excited state structures of borazanaphthalene by Reza Ghiasi, Mohammad Nikbakht

    Published 2025-09-01
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  2. 2
    Substituent effect on the electronic, structural, spectroscopic (IR and NMR) properties of H-C@Al12-Para-C6H4X clusters: A DFT outlook

    Substituent effect on the electronic, structural, spectroscopic (IR and NMR) properties of H-C@Al12-Para-C6H4X clusters: A DFT outlook by Reza Ghiasi, Rose Tale, Vahid Daneshdoost

    Published 2025-03-01
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  3. 3
    Insights into fluorine substituent effect on the electronic, optical and spectroscopic properties of borazanaphthalene

    Insights into fluorine substituent effect on the electronic, optical and spectroscopic properties of borazanaphthalene by Maryam Hajipour, Reza Ghiasi, Sahar Baniyaghoob

    Published 2025-05-01
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  4. 4
    DFT investigation of adsorptions of C2×2 and C2×4 (X=H, F) molecules on Ni-decorated Mg4O4 nanoclusters

    DFT investigation of adsorptions of C2×2 and C2×4 (X=H, F) molecules on Ni-decorated Mg4O4 nanoclusters by Shahin Abasaltian, Reza Ghiasi, Sahar Baniyaghoob

    Published 2025-12-01
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  5. 5
    External electric effect on the adsorption of benzene on Mg4O4 cluster: A DFT investigation

    External electric effect on the adsorption of benzene on Mg4O4 cluster: A DFT investigation by Maryam Taheri Jam, Reza Ghiasi, Sahar Baniyaghoob

    Published 2025-03-01
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  6. 6
    Computational illustration of reactions of Cr(CO)3(η6-Naphthalene) complex with C2X2 molecules (X = H, F, Cl)

    Computational illustration of reactions of Cr(CO)3(η6-Naphthalene) complex with C2X2 molecules (X = H, F, Cl) by Seyed Mahdi Mirtaheri, Reza Ghiasi, Mohsen Zeeb, Hossein Anaraki-Ardakani

    Published 2025-01-01
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