Publicacións nas que colabora con Miguel Ángel Ríos Fernández (5)

1999

  1. Intramolecular proton transfer in 2-(2'-hydroxyphenyl)benzoxazole: The reliability of ab initio calculations on simplified structures

    Journal of Molecular Structure: THEOCHEM, Vol. 489, Núm. 2-3, pp. 255-262

1998

  1. Direct dynamic study of the dissociation and elimination channels in the thermal decomposition of methyl nitrite

    Journal of the American Chemical Society, Vol. 120, Núm. 30, pp. 7594-7601

  2. High level and dual level direct dynamics in the intramolecular proton transfer of hydrogenoxalate anion. Influence of tunneling and isotopic effect

    Journal of Physical Chemistry A, Vol. 102, Núm. 17, pp. 2954-2961

1997

  1. Intramolecular proton transfer direct dynamics in the glycolate anion: Isotope effects

    Journal of Chemical Physics, Vol. 107, Núm. 7, pp. 2407-2414

1990

  1. Ab initio gradient conformational analysis of polyazocyclohexanes:1,4-diazocyclohexane, 1,3-diazocyclohexane and 1,3,5-triazocyclohexane

    Journal of Molecular Structure: THEOCHEM, Vol. 205, Núm. C, pp. 223-234