Anchoring the torsional potential of biphenyl at the ab initio level: The role of basis set versus correlation effects

  1. Sancho-Garcí, J.C.
  2. Cornil, J.
Revista:
Journal of Chemical Theory and Computation

ISSN: 1549-9618 1549-9626

Ano de publicación: 2005

Volume: 1

Número: 4

Páxinas: 581-589

Tipo: Artigo

DOI: 10.1021/CT0500242 GOOGLE SCHOLAR