On the efficient calculation of the quantum properties (dipolar moments) of the molecular heteroatomic (nitrogen) polycyclic aromatic hydrocarbons

Theoretical Chemistry Accounts

Volumn 128, Issue 2, 2011, Pages 223-229

  Álvarez Collado, J Ramón ^a  

^a UNIVERSIDAD AUTÓNOMA DE MADRID   (Spain)

Author keywords

Dipolar moment; Ferroelectric; Ferromagnetic; Graphene nanoribbons; Hatree Fock; Nitrogen PAHs

Indexed keywords

EID: 78651069923     PISSN: 1432881X     EISSN: None     Source Type: Journal    
DOI: 10.1007/s00214-010-0835-2     Document Type: Article

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