Publications (59) Publications in which a researcher has participated

1999

  1. Change from first- to second-order magnetic phase transition in La 2/3 (Ca, Sr) 1/3 MnO 3 perovskites

    Physical Review B - Condensed Matter and Materials Physics, Vol. 60, Núm. 5, pp. 2998-3001

  2. A DFT study of a model compound of vitamin D

    Journal of Molecular Structure: THEOCHEM, Vol. 492, Núm. 1-3, pp. 143-150

  3. A statistical study of the methyl nitrite isomerization reaction: Inverse secondary isotope effects

    Chemical Physics Letters, Vol. 310, Núm. 1-2, pp. 209-214

  4. A study of the behaviour of mixed monolayers of amphotericin B and dipalmitoyl phosphatidic acid based on hysteresis experiments

    Progress in Colloid and Polymer Science, Vol. 112, pp. 23-28

  5. A study of the stability of amphotericin B monolayers

    Progress in Colloid and Polymer Science, Vol. 112, pp. 29-33

  6. Ab Initio Study of Interactions in Hydrazine Clusters of One to Four Molecules: Cooperativity in the Interaction

    Journal of Physical Chemistry A, Vol. 103, Núm. 32, pp. 6468-6474

  7. Ab initio calculation of the frequency-dependent interaction induced hyperpolarizability of Ar2

    Journal of Chemical Physics, Vol. 110, Núm. 2-12, pp. 2872-2882

  8. Accurate intermolecular ground state potential of the Ar-N2 complex

    Journal of Chemical Physics, Vol. 110, Núm. 17, pp. 8525-8532

  9. An ab initio study of a model compound of penicillins

    Journal of Molecular Structure: THEOCHEM, Vol. 491, Núm. 1-3, pp. 177-185

  10. An analysis ofthe morphology of pK versus ionic strength curves for simple equilibria: protonation of L-leucine in NaCl as an example

    Afinidad: Revista de química teórica y aplicada, Vol. 56, Núm. 482, pp. 232-236

  11. Anfoteiicina B: Barreras biológicas

    Anales de la Real Academia de Farmacia, Vol. 65, Núm. 3, pp. 573-597

  12. Basic hydrolysis of substituted nitrophenyl acetates in β-cyclodextrin/surfactant mixed systems. Evidence of free cyclodextrin in equilibrium with micellized surfactant

    Langmuir, Vol. 15, Núm. 24, pp. 8368-8375

  13. Benzene-argon S1 intermolecular potential energy surface

    Journal of Chemical Physics, Vol. 111, Núm. 13, pp. 5922-5928

  14. Bromine-AOT charge-transfer complexes and hydrogen-bond donor ability of water in AOT-isooctane-H2O reverse micelles and water-in-oil microemulsions

    Journal of Physical Chemistry B, Vol. 103, Núm. 24, pp. 4997-5004

  15. Classical dynamics study of the unimolecular decomposition of CH3SH+

    Journal of Physical Chemistry A, Vol. 103, Núm. 48, pp. 9783-9793

  16. Complexation of 6-deoxy-6-(aminoethyl)amino-β-cyclodextrin with sodium cholate and sodium deoxycholate

    Journal of Inclusion Phenomena, Vol. 35, Núm. 1-2, pp. 335-348

  17. Complexation of sodium cholate and sodium deoxycholate by β-cyclodextrin and derivatives

    Langmuir, Vol. 15, Núm. 17, pp. 5489-5495

  18. Conformational effects on the photoinduced proton-transfer processes in 1-methyl-2-(3'-hydroxy-2'-pyridyl)benzimidazole

    Physical Chemistry Chemical Physics, Vol. 1, Núm. 2, pp. 253-260

  19. Development of an intermolecular potential function for interactions in formamide clusters based on ab initio calculations

    Journal of Chemical Physics, Vol. 110, Núm. 14, pp. 6782-6791

  20. Direct-dynamics approaches to proton tunneling rate constants. A comparative test for molecular inversions and an application to 7-azaindole tautomerization

    Journal of the American Chemical Society, Vol. 121, Núm. 26, pp. 6280-6289