Design of 9H-fluoren-9-imine based organic superbases stabilized by proton-π interactions. [PDF]
Saeidian H, Mirjafary Z.
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Unveiling the mechanism of the electroreduction of CO<sub>2</sub> to CO over ZIF-8, ZIF-67, and ZIF-90: a DFT perspective. [PDF]
Hussain I, Farooq U, Ayub K.
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Modeling graphene oxide decorated with FeO, SO and NO. [PDF]
El Meligy H +3 more
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How to evaluate aromaticity under pressure? Benzene as a benchmark system. [PDF]
Eeckhoudt J +6 more
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4-Fold Protonation of Tetracyanometalates in Superacids: Hydrogen and π-Hole Bonding in the Solid State. [PDF]
Streit TN +5 more
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Interplay between geometry, electron density, and polarizability of the controversial drug atoxyl in crystal and biological environments. [PDF]
Balmohammadi Y +5 more
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Comparative DFT analysis of CO<sub>2</sub> cycloaddition with ionic liquids in encapsulated and free states. [PDF]
Ahsan A, Lakhani A, Ayub K.
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CS-[BiC-PiC]-NiCl<sub>4</sub>: a green and effective heterogeneous catalyst for one-pot synthesis of 2,3-dihydroquinazolin-4(1<i>H</i>)-one derivatives. [PDF]
Seyedi N +3 more
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The catalyst-free green synthesis and QTAIM analysis of anilino-1,4-naphthoquinones as molecular wires. [PDF]
Rahimi M +8 more
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