Assessment of density functional approximations for N2 and CO2 physisorption on benzene and graphene

  1. Rayón, V.M.
  2. Cabria, I.
Revue:
Journal of Computational Chemistry

ISSN: 1096-987X,  0192-8651

Année de publication: 2022

Volumen: 43

Número: 21

Pages: 1403-1419

Type: Article

DOI: 10.1002/JCC.26945 GOOGLE SCHOLAR lock_openAccès ouvert editor