JESÚS
FERNÁNDEZ CASTILLO
Profesor titular de universidad
Publicaciones (72) Publicaciones en las que ha participado algún/a investigador/a
2017
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A ring polymer molecular dynamics study of the OH + H2(D2) reaction
Physical Chemistry Chemical Physics, Vol. 19, Núm. 43, pp. 29170-29176
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
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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
2014
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A ring polymer molecular dynamics study of the Cl + O3 reaction
Physical Chemistry Chemical Physics, Vol. 16, Núm. 7, pp. 2920-2927
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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
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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
2013
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A ring polymer molecular dynamics study of the isotopologues of the H + H2 reaction
Physical Chemistry Chemical Physics, Vol. 15, Núm. 10, pp. 3655-3665
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Structural and luminescence characterization of synthetic Cr-doped Ni 3(PO4)2
Journal of Physics and Chemistry of Solids, Vol. 74, Núm. 12, pp. 1678-1682
2012
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Preparation and characterization of Ce
0.95
Zr
0.05
O
2
nanopowders obtained by sol-gel and template methods
Materials Chemistry and Physics, Vol. 136, Núm. 1, pp. 160-166
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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
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Comparative study of the spectroscopic properties of Yb3/Er 3 codoped tellurite glasses modified with R2O (R=Li, Na and K)
Journal of Luminescence, Vol. 132, Núm. 2, pp. 391-397
2011
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Structural and cathodoluminiscent properties of Zr0.95Ce 0.05O2 nanopowders prepared by solgel and template methods
Journal of Luminescence, Vol. 131, Núm. 10, pp. 2128-2132
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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
2009
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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
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Structural, magnetic and luminescent characteristics of Pr 3+-doped ZrO2 powders synthesized by a sol-gel method
Journal of Physics D: Applied Physics, Vol. 42, Núm. 7
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Vibrationally inelastic collisions of H+ D2: A comparison of quantum mechanical, quasiclassical, and experimental results
Journal of Chemical Physics, Vol. 130, Núm. 3
2008
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Real wave packet and quasiclassical trajectory studies of the H+ + LiH reaction
Physical Chemistry Chemical Physics, Vol. 10, Núm. 6, pp. 821-827
2007
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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
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Cumulative reaction probabilities: A comparison between quasiclassical and quantum mechanical results
Journal of Chemical Physics, Vol. 125, Núm. 14