Chemical reactivity studies by the natural orbital functional second-order Møller–Plesset (NOF-MP2) method: water dehydrogenation by the scandium cation

  1. Mercero, J.M.
  2. Ugalde, J.M.
  3. Piris, M.
Zeitschrift:
Theoretical Chemistry Accounts

ISSN: 1432-2234 1432-881X

Datum der Publikation: 2021

Ausgabe: 140

Nummer: 6

Art: Artikel

DOI: 10.1007/S00214-021-02775-4 GOOGLE SCHOLAR