FRANCISCO JAVIER
AOIZ MOLERES
Catedrático de universidad
Instituto de Física Fundamental
Madrid, EspañaPublicaciones en colaboración con investigadores/as de Instituto de Física Fundamental (20)
2024
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Dynamical effects on the O(3P) + D2 reaction and its impact on the Λ-doublet population
Physical Chemistry Chemical Physics, Vol. 26, Núm. 8, pp. 6752-6762
2021
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Quantum study of reaction O (3P) + H2(v,j) → OH + H: OH formation in strongly UV-irradiated gas
Astronomy and Astrophysics, Vol. 648
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Temperature dependence of the rate coefficient of formation of CN radical from C + NH
Chemical Physics Letters, Vol. 771
2020
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Non-adiabatic quantum dynamics of the electronic quenching OH(A2Σ+) + Kr
Physical Chemistry Chemical Physics, Vol. 22, Núm. 30, pp. 17091-17105
2016
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Product lambda-doublet ratios as an imprint of chemical reaction mechanism
Nature Communications, Vol. 7
2015
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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
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OH+in astrophysical media: State-to-state formation rates, einstein coefficients and inelastic collision rates with He
Astrophysical Journal, Vol. 794, Núm. 1
2012
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Accurate time-dependent wave packet study of the H++LiH reaction at early universe conditions
Astrophysical Journal, Vol. 759, Núm. 1
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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
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
2009
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Effects of the rotational excitation of D2 and of the potential energy surface on the H+ + D2 →hD+ D+ reaction
Journal of Chemical Physics, Vol. 131, Núm. 4
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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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A comparison of quantum and quasiclassical statistical models for reactions of electronically excited atoms with molecular hydrogen
Journal of Chemical Physics, Vol. 129, Núm. 9
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On the dynamics of the H+ + D2 (v=0,j=0) →hD+ D+ reaction: A comparison between theory and experiment
Journal of Chemical Physics, Vol. 128, Núm. 1
2007
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A statistical quasiclassical trajectory model for atom-diatom insertion reactions
Journal of Chemical Physics, Vol. 126, Núm. 16
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Stringent test of the statistical quasiclassical trajectory model for the H3+ exchange reaction: A comparison with rigorous statistical quantum mechanical results
Journal of Chemical Physics, Vol. 127, Núm. 17
2006
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A detailed quantum mechanical and quasiclassical trajectory study on the dynamics of the H++H2→H2+H+ exchange reaction
Journal of Chemical Physics, Vol. 125, Núm. 9
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Experimental and theoretical differential cross sections for the N( 2D) + H2 reaction
Journal of Physical Chemistry A, Vol. 110, Núm. 2, pp. 817-829
2005
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Dynamics of the C( 1D)+D 2 reaction: A comparison of crossed molecular-beam experiments with quasiclassical trajectory and accurate statistical calculations
Journal of Chemical Physics, Vol. 122, Núm. 23
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Influence of rotation and isotope effects on the dynamics of the N ( 2D) + H 2 reactive system and of its deuterated variants
Journal of Chemical Physics, Vol. 123, Núm. 22