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DFT study of clofazimine and its interactions with the p-aminobenzoic acid coformer in the formation of an amorphous material
Vol 21, 2021 -141732 -
DFT study of structure and electronic properties of dapsone and its interactions with oxalic acid in the formation of the amorphous material
Vol 21, 2021 -141750 -
DFT studies and Hirshfeld analysis of a new Tutton salt crystal
Vol 21, 2021 -141771 -
DFT study of the dichloro(L-histidine) copper(II) coordination complex
Vol 21, 2021 -141744 -
DFT study of rifampicin and its interaction with tromethamine in the formation of an amorphous material
Vol 21, 2021 -141755
Publications in other proceedings
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SBQT 2023
Obtention, characterization, and DFT study of the [Cu(Phen)(L-Asparagine)H2OCl] coordination complex
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SBQT 2023
A DFT study of a novel Zn(II) coordination complex with 1,10-phenanthroline and purpurin ligands
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SBQT 2023
Physicochemical properties and phase transitions of (NH4)2Zn(SO4)2(H2O)6 crystals: a theoretical and experimental study
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SBQT 2023
Structural, vibrational, and electronic properties of the [Ni(Phen)(C4H2O4)(H2O)3] coordination complex: Synthesis and DFT study
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SBQT 2023
Properties of agrochemicals for the development of sensors
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