Publicaciones en colaboración con investigadores/as de Universidad de Buenos Aires (6)

2022

  1. Grazing incidence fast atom and molecule diffraction: theoretical challenges

    Physical Chemistry Chemical Physics, Vol. 24, Núm. 26, pp. 15628-15656

2013

  1. Computational NMR coupling constants: Shifting and scaling factors for evaluating 1JCH

    Magnetic Resonance in Chemistry, Vol. 51, Núm. 12, pp. 775-787

2010

  1. NMR spin-spin coupling constants and hyperconjugative interactions

    International Journal of Quantum Chemistry, Vol. 110, Núm. 3, pp. 532-539

2008

  1. Karplus equation for3JHH spin-spin couplings with unusual3J(180°) < 3J(0°) relationship

    Journal of Chemical Theory and Computation, Vol. 4, Núm. 9, pp. 1494-1500

  2. On the unusual 2JC2-Hf coupling dependence on syn/anti CHO conformation in 5-X-furan-2-carboxaldehydes

    Magnetic Resonance in Chemistry, Vol. 46, Núm. 9, pp. 846-850

2007

  1. Theoretical Karplus relationships for vicinal coupling constants around χ1 in Valine

    Chemical Physics Letters, Vol. 442, Núm. 1-3, pp. 119-123