Artículos (24) Publicaciones en las que ha participado algún/a investigador/a

1990

  1. Analysis of the CIPSI/DCCI approach to characterize the HF AND F2 single bond

    Chemical Physics, Vol. 141, Núm. 2-3, pp. 285-295

  2. Calculation of the relative basicities of methylamines in solution

    Chemical Physics Letters, Vol. 169, Núm. 4, pp. 297-300

  3. Discontinuity of valence CASSCF wave functions around weakly avoided crossing between valence configurations

    Chemical Physics Letters, Vol. 172, Núm. 2, pp. 163-168

  4. ESTUDIO POR CONECTIVIDAD MOLECULAR DE DIVERSAS PROPIEDADES FARMACOLOGICAS DE UN GRUPO DE ANALGESICOS

    Anales de la Real Academia de Farmacia, Vol. 56, Núm. 3, pp. 347-358

  5. ESTUDIO TERMODINAMICO Y CINETICO DE LA REACCION ENTRE LA HIDRALACINA Y EL 2-HIDROXI-1-NAFTALDEHIDO

    Anales de la Real Academia de Farmacia, Vol. 56, Núm. 2, pp. 245-254

  6. ESTUDIOS DE ANALGESIA REALIZADOS A UN GRUPO DE ESTRUCTURAS QUIMICAS OBTENIDAS POR DISENO MOLECULAR

    Revista de Farmacologia Clinica y Experimental, Vol. 7, Núm. 4, pp. 209-211

  7. Electronic structure of phthalocyanines: Theoretical investigation of the optical properties of phthalocyanine monomers, dimers, and crystals

    The Journal of Chemical Physics, Vol. 92, Núm. 2, pp. 1228-1235

  8. GEPOL: An improved description of molecular surfaces. I. Building the spherical surface set

    Journal of Computational Chemistry, Vol. 11, Núm. 9, pp. 1047-1060

  9. HCnN: The largest molecules in the interstellar medium

    Journal Of Chemical Education, Vol. 67, Núm. 11, pp. 905-906

  10. Influence of Annelation on the Electronic Properties of Phthalocyanine Macrocycles

    Chemistry of Materials, Vol. 2, Núm. 2, pp. 110-116

  11. Modified hydrodynamic chromatography and its applications to liposomes

    Journal of High Resolution Chromatography, Vol. 13, Núm. 8, pp. 583-584

  12. Molecular volumes and surfaces of biomacromolecules via GEPOL: A fast and efficient algorithm

    Journal of Molecular Graphics, Vol. 8, Núm. 3, pp. 168-172

  13. Multi-component analysis using OPKINE, a program for the non-linear treatment of kinetic problems

    The Analyst, Vol. 115, Núm. 6, pp. 721-724

  14. Non-exclusion phenomena in size exclusion chromatography with inorganic porous packing: a thermodynamic treatment

    Polymer, Vol. 31, Núm. 9, pp. 1694-1702

  15. On the dissociation energy of Cu2 and CuH using a differential correlation approach

    Chemical Physics, Vol. 148, Núm. 1, pp. 69-76

  16. Oxidative coupling of methane on Mgo. ab initio UHF potential energy surface

    Journal of Molecular Structure: THEOCHEM, Vol. 208, Núm. 3-4, pp. 153-162

  17. Photophysical behavior of norharmane related to proximity effect

    Journal of Luminescence, Vol. 47, Núm. 1-2, pp. 27-34

  18. Predictability of properties of ternary systems solvent/solvent/polymer from interaction parameters of the binary systems-III. Analysis of binary potential functions forming ternary ones

    European Polymer Journal, Vol. 26, Núm. 7, pp. 805-810

  19. Selected dissociation- and correlation-consistent configuration interaction by a perturbative criterion

    The Journal of Chemical Physics, Vol. 93, Núm. 1, pp. 495-501

  20. Solution properties of polyelectrolytes-V. Viscometric study of mixed polyanions in pure water

    European Polymer Journal, Vol. 26, Núm. 7, pp. 767-773