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

Crossref DOI link: https://doi.org/10.1007/s11224-024-02427-w

Published Online: 2024-12-04

Published Print: 2025-06

Update policy: https://doi.org/10.1007/springer_crossmark_policy

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