Publicaciones en las que colabora con JESÚS FERNÁNDEZ CASTILLO (40)

2015

  1. Accurate Time-Dependent Wave Packet Calculations for the O+ + H2 → OH+ + H Ion-Molecule Reaction

    Journal of Physical Chemistry A, Vol. 119, Núm. 50, pp. 11951-11962

2014

  1. State-to-state quantum wave packet dynamics of the LiH + H reaction on two AB initio potential energy surfaces

    Astrophysical Journal, Vol. 784, Núm. 1

2012

  1. Accurate time-dependent wave packet study of the H++LiH reaction at early universe conditions

    Astrophysical Journal, Vol. 759, Núm. 1

  2. Accurate time-dependent wave packet study of the Li + H 2 + reaction and its isotopic variants

    Journal of Physical Chemistry A, Vol. 116, Núm. 1, pp. 132-138

2009

  1. Quantum mechanical wave packet and quasiclassical trajectory calculations for the Li + H2+ reaction

    Journal of Physical Chemistry A, Vol. 113, Núm. 52, pp. 14657-14663

2008

  1. Real wave packet and quasiclassical trajectory studies of the H+ + LiH reaction

    Physical Chemistry Chemical Physics, Vol. 10, Núm. 6, pp. 821-827

2007

  1. Wave packet and quasiclassical trajectory calculations for the N(2D) + H2 reaction and its isotopic variants

    Chemical Physics, Vol. 332, Núm. 1, pp. 119-131

2006

  1. Quasiclassical trajectory study of the Cl+CH4 reaction dynamics on a quadratic configuration interaction with single and double excitation interpolated potential energy surface

    Journal of Chemical Physics, Vol. 125, Núm. 12

2005

  1. Dynamics of the O(1D)+D2 reaction: A comparison between crossed molecular beam experiments and quasiclassical trajectory calculations on the lowest three potential energy surfaces

    Molecular Physics, Vol. 103, Núm. 13, pp. 1703-1714

  2. Quantum mechanical and quasi-classical trajectory reaction probabilities and cross sections for the S(1D) + H2,D2,HD insertion reactions

    Physical Chemistry Chemical Physics, Vol. 7, Núm. 4, pp. 627-634

  3. Quantum state distributions for reactive and inelastic H+D-2 collisions.

    ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY

  4. Quasiclassical trajectory study of the F + CH4 reaction dynamics on a dual-level interpolated potential energy surface

    Journal of Physical Chemistry A, Vol. 109, Núm. 38, pp. 8459-8470

2004

  1. Cross-sections for the H + H 2 O → OH + H 2 and H + D 2 O → OD + HD abstraction reactions

    Physical Chemistry Chemical Physics, Vol. 6, Núm. 21, pp. 4991-4999

  2. Collision energy dependence of the HD(v′ = 2) product rotational distribution of the H+D 2 reaction in the range 1.30-1.89 eV

    Journal of Chemical Physics, Vol. 120, Núm. 7, pp. 3255-3264

  3. Disagreement between theory and experiment in the simplest chemical reaction: Collision energy dependent rotational distributions for H+D 2→HD(v′ = 3,J′) + D

    Journal of Chemical Physics, Vol. 120, Núm. 7, pp. 3244-3254

  4. Further investigation of the HCl elimination in the photodissociation of vinyl chloride at 193 nm: A direct MP2/6-31G(d,p) trajectory study

    Chemical Physics Letters, Vol. 386, Núm. 4-6, pp. 225-232

  5. Rovibrational product state distribution for inelastic H+D 2 collisions

    Journal of Chemical Physics, Vol. 121, Núm. 14, pp. 6587-6590

  6. The H + N 2O → OH + N 2 reaction dynamics on an interpolated QCISD potential energy surface. A quasiclassical trajectory study

    Journal of Physical Chemistry A, Vol. 108, Núm. 32, pp. 6611-6623

2003

  1. Cross Section for the [Formula presented] Abstraction Reaction: Experiment and Theory

    Physical Review Letters, Vol. 90, Núm. 9, pp. 4

  2. Cross section for the H + H2O abstraction reaction: Experiment and theory

    Physical Review Letters, Vol. 90, Núm. 9