Post-B3LYP Functionals Do Not Improve the Description of Magnetic Coupling in Cu(II) Dinuclear Complexes

  1. Costa, R.
  2. Reta, D.
  3. Moreira, I.D.P.R.
  4. Illas, F.
Revue:
Journal of Physical Chemistry A

ISSN: 1520-5215 1089-5639

Année de publication: 2018

Volumen: 122

Número: 13

Pages: 3423-3432

Type: Article

DOI: 10.1021/ACS.JPCA.7B12663 GOOGLE SCHOLAR