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Fine-Tuning of the Electronic and Optical Properties of Dodecabenzocoronene through Boron and Nitrogen Doping: A DFT Insight.
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- Journal of Computational Biophysics & Chemistry, 2023, v. 22, n. 8, p. 965, doi. 10.1142/S273741652342005X
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Structures, Characterization and DFT Studies of Four Novel Nickel Phenanthroline Complexes.
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- Crystals (2073-4352), 2023, v. 13, n. 5, p. 738, doi. 10.3390/cryst13050738
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- Article
Hydrogen Dissociation Reaction on First-Row Transition Metal Doped Nanobelts.
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- Materials (1996-1944), 2023, v. 16, n. 7, p. 2792, doi. 10.3390/ma16072792
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- Article
Efficient Detection of Nerve Agents through Carbon Nitride Quantum Dots: A DFT Approach.
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- Nanomaterials (2079-4991), 2023, v. 13, n. 2, p. 251, doi. 10.3390/nano13020251
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- Article
Remarkable Single Atom Catalyst of Transition Metal (Fe, Co & Ni) Doped on C 2 N Surface for Hydrogen Dissociation Reaction.
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- Nanomaterials (2079-4991), 2023, v. 13, n. 1, p. 29, doi. 10.3390/nano13010029
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- Article