On the effects of the basis set superposition error on the change of QTAIM charges in adduct formation. Application to complexes between morphine and cocaine and their main metabolites

  1. Rincón, D.A.
  2. Cordeiro, M.N.D.S.
  3. Mosquera, R.A.
Revue:
RSC Advances

ISSN: 2046-2069

Année de publication: 2016

Volumen: 6

Número: 112

Pages: 110642-110655

Type: Article

DOI: 10.1039/C6RA22736H GOOGLE SCHOLAR