Spin adapted versus broken symmetry approaches in the description of magnetic coupling in heterodinuclear complexes

  1. Costa, R.
  2. Valero, R.
  3. Mañeru, D.R.
  4. Moreira, I.D.P.R.
  5. Illas, F.
Revue:
Journal of Chemical Theory and Computation

ISSN: 1549-9626 1549-9618

Année de publication: 2015

Volumen: 11

Número: 3

Pages: 1006-1019

Type: Article

DOI: 10.1021/CT5011483 GOOGLE SCHOLAR