Catálise Organometálica
CatOrg (GI-1603)
Universidad Complutense de Madrid
Madrid, EspañaPublicacións en colaboración con investigadores/as de Universidad Complutense de Madrid (12)
2020
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Femtochemistry under scrutiny: Clocking state-resolved channels in the photodissociation of CH3I in the A -band
Journal of Chemical Physics, Vol. 152, Núm. 1
2019
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Carbon Nanotubes Conjugated with Triazole-Based Tetrathiafulvalene-Type Receptors for C60 Recognition
ChemPlusChem, Vol. 84, Núm. 6, pp. 730-739
2015
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Electroactive carbon nanoforms: A comparative study via sequential arylation and click chemistry reactions
Nanoscale, Vol. 7, Núm. 3, pp. 1193-1200
2014
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Unprecedented chemical reactivity of a paramagnetic endohedral metallofullerene La@Cs-C82 that leads hydrogen addition in the 1,3-dipolar cycloaddition reaction
Journal of the American Chemical Society, Vol. 136, Núm. 50, pp. 17537-17546
2006
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Quasiclassical trajectory study of the collision-induced dissociation dynamics of Ar + CH3SH+ using an Ab initio interpolated potential energy surface
Journal of Physical Chemistry A, Vol. 110, Núm. 4, pp. 1225-1231
2005
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On the conformational memory in the photodissociation of formic acid
Journal of Physical Chemistry A, Vol. 109, Núm. 12, pp. 2836-2839
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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
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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
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RRKM and direct MP2/6-31G(d,p) quasiclassical trajectory study of the H 2 elimination in the photodissociation of vinyl chloride at 193 nm
Chemical Physics Letters, Vol. 396, Núm. 4-6, pp. 442-447
2003
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A Direct Classical Trajectory Study of HCl Elimination from the 193 nm Photodissociation of Vinyl Chloride
Journal of Physical Chemistry A, Vol. 107, Núm. 38, pp. 7611-7618
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A direct classical trajectory study of the acetone photodissociation on the triplet surface
Journal of Chemical Physics, Vol. 119, Núm. 20, pp. 10618-10625
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Quasi-classical trajectory study of H2 elimination in the photodissociation of difluoroethylenes at 193 nm
Journal of Chemical Physics, Vol. 118, Núm. 15, pp. 6941-6945