Publicaciones en colaboración con investigadores/as de University of Alberta (3)

2023

  1. Accurate Potential Energy Surfaces Using Atom-Centered Potentials and Minimal High-Level Data

    Journal of Physical Chemistry A, Vol. 127, Núm. 38, pp. 8015-8024

2013

  1. Efficient basis sets for non-covalent interactions in XDM-corrected density-functional theory

    Journal of Chemical Physics, Vol. 139, Núm. 21

  2. Performance of conventional and dispersion-corrected density-functional theory methods for hydrogen bonding interaction energies

    Physical Chemistry Chemical Physics, Vol. 15, Núm. 31, pp. 12821-12828