Publications (17) Publications in which a researcher has participated

2003

  1. A new vanadium(III) fluorophosphate with ferromagnetic interactions, (NH4)[V(PO4)F]

    Journal of Solid State Chemistry, Vol. 173, Núm. 1, pp. 101-108

  2. A theoretical evaluation of the pKa for twisted amides using density functional theory and dielectric continuum methods

    Journal of Physical Chemistry A, Vol. 107, Núm. 31, pp. 6099-6107

  3. Clusters of group II - VI materials: CdiOi (i ≤ 15)

    Journal of Physical Chemistry A, Vol. 107, Núm. 46, pp. 9918-9923

  4. Coordination modes in a tridentate NNS (thiosemicarbazonato)copper(II) system containing oxygen-donor coligands - Structures of [{Cu(L)(X)}2] (X = formato, propionato, nitrito)

    European Journal of Inorganic Chemistry, pp. 518-527

  5. Electron correlation: Quantum chemistry's holy grail

    METAL-LIGAND INTERACTIONS: MOLECULAR, NANO-, MICRO-, AND MACRO-SYSTEMS IN COMPLEX ENVIRONMENTS

  6. Electronic excitation energies of ZniOi clusters

    Journal of the American Chemical Society, Vol. 125, Núm. 31, pp. 9494-9499

  7. Electronic resonance states in metallic nanowires during the breaking process simulated with the ultimate jellium model

    Physical Review B - Condensed Matter and Materials Physics, Vol. 67, Núm. 7

  8. Estudio de la composición isotópica del Pb en galenas del distrito minero de Linares-La Carolina (Jaén, España)

    Geogaceta, Núm. 34, pp. 31-34

  9. Fe(AsO4): A new iron(III) arsenate synthesized from thermal treatment of (NH4)[Fe(AsO4)F]

    Chemical Communications, Vol. 3, Núm. 5, pp. 622-623

  10. Geocronología del plutón de Campanario-La Haba (Badajoz) a partir del análisis de isótopos de Pb en circones y U-Th-Pbtotal en monacitas

    Geogaceta, Núm. 34, pp. 27-30

  11. Heterogeneidad isotópica del Pb en los yacimientos filonianos del valle de Alcudia (España). Implicaciones genéticas.

    Boletín de la Sociedad Española de Mineralogía, Vol. 26, Núm. 0, pp. 167-168

  12. Hydrothermal synthesis, crystal structure, and spectroscopic and magnetic properties of a new organically templated mixed-anion fluoro-arsenate-phosphate iron(III) compound (see abstract)

    Solid State Sciences, Vol. 5, Núm. 9, pp. 1291-1301

  13. Hydrothermal synthesis, crystal structure, and spectroscopic characterization of a new organically templated mixed-anion fluoro-arsenate-phosphate iron(III) compound, (C2H10N2)[Fe2(AsO4)2 -x(PO4)xF2(H2O)] (x = 0.46)

    Materials Research Bulletin, Vol. 38, Núm. 7, pp. 1193-1202

  14. Hydrothermal synthesis, crystal structures, spectroscopic, and magnetic properties of two new organically templated monodimensional phosphite compounds: (C2H10N2)[M(HPO3)F3], M = V(III) and Cr(III)

    Chemistry of Materials, Vol. 15, Núm. 5, pp. 1204-1209

  15. Incremental binding free energies of aluminum (III) vs. magnesium (II) complexes

    Chemical Physics, Vol. 295, Núm. 2, pp. 175-184

  16. Magnetic properties of M(PO3)3 (M = Fe, Mo). A comparative neutron diffraction study

    Journal of Materials Chemistry, Vol. 13, Núm. 7, pp. 1723-1730

  17. The electronic states of Fe2+

    Chemical Physics Letters, Vol. 376, Núm. 3-4, pp. 310-317