Publications (10) FERNANDO RUIPEREZ CILLAN publications

filter_list General Chemistry

2013

  1. Computational study of Be2 using Piris natural orbital functionals

    Journal of Molecular Modeling, Vol. 19, Núm. 5, pp. 1967-1972

  2. Molecules with high bond orders and ultrashort bond lengths: CrU, MoU, and WU

    Inorganic Chemistry, Vol. 52, Núm. 6, pp. 2838-2843

2011

  1. A natural orbital functional for multiconfigurational states

    Journal of Chemical Physics, Vol. 134, Núm. 16

  2. Electronic structure and bonding in heteronuclear dimers of V, Cr, Mo, and W: A CASSCF/CASPT2 study

    Inorganic Chemistry, Vol. 50, Núm. 19, pp. 9219-9229

  3. Pro-oxidant activity of aluminum: Stabilization of the aluminum superoxide radical ion

    Journal of Physical Chemistry A, Vol. 115, Núm. 24, pp. 6717-6723