Publikationen, an denen er mitarbeitet Frances Illas Riera (5)

2007

  1. Merging multiconfigurational wavefunctions and correlation functional to predict magnetic coupling constants

    Journal of Computational Chemistry, Vol. 28, Núm. 16, pp. 2559-2568

2004

  1. Density functional theory with alternative spin densities: Application to magnetic systems with localized spins

    Journal of Chemical Physics, Vol. 120, Núm. 1, pp. 18-25

  2. Structural and spectroelectrochemical study of carbonate and bicarbonate adsorbed on Pt(111) and Pd/Pt(lll) electrodes

    Journal of Physical Chemistry B, Vol. 108, Núm. 46, pp. 17928-17939

2001

  1. Adsorption of CO at palladium monolayers deposited on Pt(111) electrodes. Combined spectroelectrochemical and theoretical study

    Journal of Physical Chemistry B, Vol. 105, Núm. 30, pp. 7263-7271

1995

  1. Performance of correlation functionals in ab initio chemisorption cluster-model calculations: Alkali metals on Si(111)

    Physical Review B, Vol. 52, Núm. 16, pp. 11998-12005