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.
Aldizkaria:
Journal of Chemical Theory and Computation

ISSN: 1549-9618 1549-9626

Argitalpen urtea: 2005

Alea: 1

Zenbakia: 4

Orrialdeak: 581-589

Mota: Artikulua

DOI: 10.1021/CT0500242 GOOGLE SCHOLAR