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Cited article:

Study of heteroatom-doped graphene properties using DFT/TD-DFT, QTAIM, NBO, and NCI calculations

Ines Boudjahem, Abderrafik Nemamcha, Hayet Moumeni and Nawal Brahimi
Structural Chemistry 36 (3) 947 (2025)
https://doi.org/10.1007/s11224-024-02427-w