José María
Alvariño Herrero
Universidad de Salamanca
Salamanca, EspañaPublications en collaboration avec des chercheurs de Universidad de Salamanca (51)
2012
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Dynamics of the D + + H 2 and H + + D 2 reactions: A detailed comparison between theory and experiment
Physical Chemistry Chemical Physics, Vol. 14, Núm. 10, pp. 3346-3359
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Elucidation of the O( 1D) + HF → F + OH mechanism by means of quasiclassical trajectories
Physical Chemistry Chemical Physics, Vol. 14, Núm. 47, pp. 16338-16348
2011
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Energy dependent dynamics of the O(1D) + HCl reaction: A quantum, quasiclassical and statistical study
Physical Chemistry Chemical Physics, Vol. 13, Núm. 18, pp. 8502-8514
2010
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Reaction dynamics of the D+ + H2 system. A comparison of theoretical approaches
Physical Chemistry Chemical Physics, Vol. 12, Núm. 39, pp. 12591-12603
2009
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The dynamics of the O(1D) + HCl →OH + Cl reaction at a 0.26 eV Collision energy: a comparison between theory and experiment
Journal of Physical Chemistry A, Vol. 113, Núm. 52, pp. 14237-14250
2008
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On the features of statistical behaviour of the O(3P)+HCl(v = 2, j = 1,6,9) → OH + Cl reaction
European Physical Journal D, Vol. 47, Núm. 2, pp. 181-189
2006
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Analysis of the H + D2 reaction mechanism through consideration of the intrinsic reactant polarisation
Physical Chemistry Chemical Physics, pp. 4881-4896
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Mechanism and control of the F+H 2 reaction at low and ultralow collision energies
Journal of Chemical Physics, Vol. 125, Núm. 13
2005
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F+OH reactive collisions on new excited 3A″ and 3A′ potential-energy surfaces
Journal of Chemical Physics, Vol. 123, Núm. 11
2004
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Direct versus resonances mediated F+OH collisions on a new 3A″ potential energy surface
Journal of Chemical Physics, Vol. 121, Núm. 10, pp. 4605-4618
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Dynamics and kinetics of the F + OH reaction on the ground triplet potential energy surface
Chemical Physics Letters, Vol. 383, Núm. 1-2, pp. 25-30
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Photodetachment spectrum of OHF-: Three-dimensional study of the heavy-light-heavy resonances
Journal of Chemical Physics, Vol. 121, Núm. 1, pp. 309-320
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Quantum stereodynamics of the F + H2 → HF + H reaction by the stereodirected S-matrix approach
Chemical Physics
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Quantum stereodynamics of the F + OH(v, j) reactive collision on the 1 3A″ state
Molecular Physics, Vol. 102, Núm. 21-22, pp. 2381-2392
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Transition state dynamics of OHF on several electronic states: Photodetachment spectrum of OHF- and conical intersections
Journal of Chemical Physics, Vol. 121, Núm. 20, pp. 9865-9875
2003
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A detailed study of the dynamics of the O(1D)+HCl→OH+Cl, ClO+H reactions
Journal of Chemical Physics, Vol. 119, Núm. 15, pp. 7871-7886
2001
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Dinámica de las reacciones químicas. I
Química teórica y computacional (Servei de Comunicació i Publicacions), pp. 281-312
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Progress in validating the potential energy surface of the OH+H2 reaction: Product vibrational distributions
Chemical Physics Letters, Vol. 345, Núm. 3-4, pp. 219-227
2000
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Quasiclassical trajectory simulation of the O(1D) + HCl → OH + Cl, ClO + H reactions on an improved potential energy surface
Physical Chemistry Chemical Physics, Vol. 2, Núm. 4, pp. 589-597
1999
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Double-well structure and microscopic branching in the O(1D)+HCl reaction
Chemical Physics Letters, Vol. 313, Núm. 1-2, pp. 299-306