Evaluation of modern DFT functionals and G3n-RAD composite methods in the modelization of organic singlet diradicals
- López-Carballeira, D.
- Ruipérez, F.
ISSN: 0948-5023, 1610-2940
Ano de publicación: 2016
Volume: 22
Número: 4
Tipo: Artigo
Revista:
Journal of Molecular Modeling