Publikationen in Zusammenarbeit mit Forschern von Universidad de Valladolid (36)

2014

  1. Experimental and theoretical studies on the effect of the oxo group in 1,4-benzodiazepines

    Organic and Biomolecular Chemistry, Vol. 12, Núm. 27, pp. 4905-4916

2013

  1. Semiempirical fine-tuning for Hartree-Fock ionization potentials of atomic ions with non-integral atomic number

    Physics Letters, Section A: General, Atomic and Solid State Physics, Vol. 377, Núm. 41, pp. 2955-2958

2011

  1. Surfactant effect of sulfuric acid on the exfoliation of bilayer graphene

    Physical Review B - Condensed Matter and Materials Physics, Vol. 84, Núm. 16

2010

  1. Interaction of surfactants containing a sulfuric group with a (5,5) carbon nanotube

    Journal of Physical Chemistry C, Vol. 114, Núm. 41, pp. 17249-17256

2008

  1. Interaction and concerted diffusion of lithium in a (5,5) carbon nanotube

    Physical Review B - Condensed Matter and Materials Physics, Vol. 78, Núm. 11

2007

  1. Ionization potentials of neutral atoms and positive ions in the limit of large atomic number

    Physical Review A - Atomic, Molecular, and Optical Physics, Vol. 75, Núm. 1

  2. Stability of silicon-doped C60 dimers

    Journal of Chemical Physics, Vol. 126, Núm. 4

  3. The interaction of sulfuric acid with graphene and formation of adsorbed crystals

    Nanotechnology, Vol. 18, Núm. 48

  4. Two-parameter partially correlated ground-state electron density of some light spherical atoms from Hartree-Fock theory with nonintegral nuclear charge

    Physical Review A - Atomic, Molecular, and Optical Physics, Vol. 75, Núm. 5

2005

  1. Simulating the thermal behavior and fragmentation mechanisms of exohedral and substitutional silicon-doped C 60

    Journal of Chemical Physics, Vol. 123, Núm. 20

2004

  1. Interaction of lithium with graphene: An ab initio study

    Physical Review B - Condensed Matter and Materials Physics, Vol. 70, Núm. 12

  2. Relativistic theory of an inhomogeneous electron liquid in relation to atomic binding energies

    Physics and Chemistry of Liquids, Vol. 42, Núm. 6, pp. 589-595

2003

  1. Correlation energies of light atoms related to pairing between antiparallel spin electrons

    Journal of Physics B: Atomic, Molecular and Optical Physics, Vol. 36, Núm. 13, pp. 2695-2705

  2. Structural and thermal properties of silicon-doped fullerenes

    Journal of Chemical Physics, Vol. 119, Núm. 2, pp. 1127-1135

  3. Tight binding studies of exohedral silicon doped C60

    Composites Science and Technology, Vol. 63, Núm. 11, pp. 1499-1505

2001

  1. Exchange energy density and some approximate exchange potentials obtained from Hartree-Fock theory of the ground state of the Be atom

    Chemical Physics Letters, Vol. 343, Núm. 1-2, pp. 166-170

2000

  1. New perspectives of the weighted spin-density approximation: Gradient corrections and the valence-only approach

    Journal of Molecular Structure: THEOCHEM, Vol. 501-502, pp. 153-166

1999

  1. Simulating the thermal stability and phase changes of small carbon clusters and fullerenes

    European Physical Journal D, Vol. 6, Núm. 2, pp. 221-233

1998

  1. Gradient correction to the exchange pair-correlation function of the weighted spin-density approximation in the density functional formalism

    Chemical Physics Letters, Vol. 296, Núm. 3-4, pp. 307-312

1997

  1. A curvature-based derivation of the Schwarzschild metric

    American Journal of Physics, Vol. 65, Núm. 12, pp. 1200-1209