The use of "ab initio" net charges to improve Fraga's atom-atom pair potential for molecular association

  1. Torrens, F.
  2. Sánchez-de-Merás, A.-M.
  3. Sánchez-Marín, J.
Revue:
Journal of Molecular Structure: THEOCHEM

ISSN: 0166-1280

Année de publication: 1988

Volumen: 166

Número: C

Pages: 135-140

Type: Article

DOI: 10.1016/0166-1280(88)80426-3 GOOGLE SCHOLAR
La source de données: Scopus