Publications by the researcher in collaboration with Jesús Fernández Castillo (16)

2015

  1. The Cl + O<inf>3</inf> reaction: A detailed QCT simulation of molecular beam experiments

    Physical Chemistry Chemical Physics, Vol. 17, Núm. 38, pp. 25471-25482

2011

  1. Theoretical study of the dynamics of Cl + O3 reaction I. Ab initio potential energy surface and quasiclassical trajectory results

    Physical Chemistry Chemical Physics, Vol. 13, Núm. 18, pp. 8537-8548

2002

  1. A quasiclassical trajectory and quantum mechanical study of the O(1D) + D2 reaction dynamics. Comparison with high resolution molecular beam experiments

    Physical Chemistry Chemical Physics, Vol. 4, Núm. 18, pp. 4379-4385

  2. A quasiclassical trajectory study of the H + H2O → OH + H2 reaction dynamics at 1.4 eV collision energy on a new ab initio potential energy surface

    Chemical Physics Letters, Vol. 356, Núm. 1-2, pp. 120-126

  3. Energy dependence of forward scattering in the differential cross section of the H+D2→ HD(v′ = 3,j′ = 0) + D reaction

    Journal of Chemical Physics, Vol. 117, Núm. 6, pp. 2546

  4. The O(1D)+H2 reaction at 56 meV collision energy: A comparison between quantum mechanical, quasiclassical trajectory, and crossed beam results

    Journal of Chemical Physics, Vol. 116, Núm. 24, pp. 10692-10703

  5. The dynamics of the H + H2O reaction

    ChemPhysChem, Vol. 3, Núm. 4, pp. 320-332

2001

  1. A quantum mechanical and quasi-classical trajectory study of the Cl+H2 reaction and its isotopic variants: Dependence of the integral cross section on the collision energy and reagent rotation

    Journal of Chemical Physics, Vol. 115, Núm. 5, pp. 2074-2081

  2. Experimental and theoretical differential cross sections for the reactions CL+H2/D2

    Journal of Chemical Physics, Vol. 114, Núm. 24, pp. 10662-10672

  3. Forward scattering in the H+D2→HD+D reaction: Comparison between experiment and theoretical predictions

    Journal of Chemical Physics, Vol. 115, Núm. 10, pp. 4534-4545

  4. Insertion and abstraction pathways in the reaction O(1D2) + H2 → OH + H

    Physical Review Letters, Vol. 86, Núm. 9, pp. 1729-1732

  5. On the existence of resonances in the H+D2→HD(v′ = 0,j′ = 7) + D reaction at collision energies 0.6-1.3 eV

    Journal of Chemical Physics, Vol. 114, Núm. 19, pp. 8237-8239

  6. The stereodynamics of the O(1D) + HD reaction on the ground 1 1A′ and excited 1 1A″ potential energy surfaces

    Journal of Chemical Physics, Vol. 114, Núm. 19, pp. 8328-8338

1999

  1. The dynamics of the hydrogen exchange reaction at 2.20 eV collision energy: Comparison of experimental and theoretical differential cross sections

    Journal of Chemical Physics, Vol. 110, Núm. 20, pp. 9971-9981

1998

  1. Quantum mechanical and quasiclassical simulations of molecular beam experiments for the F+H2→HF+H reaction on two ab initio potential energy surfaces

    Journal of Chemical Physics, Vol. 109, Núm. 17, pp. 7224-7237

1997

  1. Ab initio simulation of molecular beam experiments for the F + H2 → HF + H reaction

    Journal of Physical Chemistry A, Vol. 101, Núm. 36, pp. 6403-6414