Hirshfeld-based atomic population analysis of the B, N doping effect in zigzag graphene nanoribbons: π electron density as requirement to follow the B, N doping guidelines
- Otero, N.
- Karamanis, P.
- Pouchan, C.
Zeitschrift:
Theoretical Chemistry Accounts
ISSN: 1432-881X
Datum der Publikation: 2018
Ausgabe: 137
Nummer: 2
Art: Artikel