ANTONIO
LARGO CABRERIZO
CATEDRATICOS DE UNIVERSIDAD
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Universidad de Oviedo
Oviedo, EspañaPublicacions en col·laboració amb investigadors/es de Universidad de Oviedo (41)
2024
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Structure and Spectroscopic Insights for CH3PCO Isomers: A High-Level Quantum Chemical Study
Journal of Physical Chemistry A, Vol. 128, Núm. 20, pp. 4083-4091
2014
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Halogen-abstraction reactions from chloromethane and bromomethane molecules by alkaline-earth monocations
Physical Chemistry Chemical Physics, Vol. 16, Núm. 30, pp. 16121-16136
2013
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Kinetics studies of the reactions of main fourth-period monocations (Ga+, Ge+, As+, and Se+) with methyl fluoride
Journal of Physical Chemistry A, Vol. 117, Núm. 33, pp. 7742-7753
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Reactivity of first-row transition metal monocations (Sc+, Ti+, V+, Zn+) with methyl fluoride: A computational study
Journal of Physical Chemistry A, Vol. 117, Núm. 14, pp. 2932-2943
2011
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Theoretical study of the C-F bond activation in methyl fluoride by alkaline-earth metal monocations
Theoretical Chemistry Accounts, Vol. 128, Núm. 4, pp. 609-618
2009
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Polyisocyanides of titanium
Journal of Physical Chemistry A, Vol. 113, Núm. 8, pp. 1574-1577
2006
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A computational study on the reaction of N(2D) atoms with CH2Cl radicals
Chemical Physics Letters, Vol. 422, Núm. 1-3, pp. 276-281
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On the reaction of ground-state nitrogen atoms with bromomethyl radicals: A computational study
International Journal of Mass Spectrometry, Vol. 249-250, pp. 451-461
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Reaction of N(2D) atoms with bromomethyl radicals: A theoretical study
Chemical Physics, Vol. 328, Núm. 1-3, pp. 45-52
2005
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A computational study of the reaction of ground-state nitrogen atoms with chloromethyl radicals
Journal of Physical Chemistry A, Vol. 109, Núm. 29, pp. 6540-6548
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Computational study of the reaction of N ( 2D) atoms with C H 2 F radicals: An example of a barrier-free reaction involving very high internal energies
Journal of Chemical Physics, Vol. 123, Núm. 11
2003
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Computational study on the kinetics of the reaction of N(4S) with CH2F
Chemical Physics Letters, Vol. 374, Núm. 5-6, pp. 594-600
2001
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The reaction of N(4S) with CH2F: A comparative ab initio and DFT study
Journal of Physical Chemistry A, Vol. 105, Núm. 43, pp. 9917-9925
1998
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Theoretical study of possible interstellar processes for the production of C2Cl precursors
Journal of Molecular Structure: THEOCHEM, Vol. 432, Núm. 1, pp. 75-88
1996
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Reaction of carbon atoms with H2Cl+: An ab initio study of a possible interstellar process
Journal of Molecular Structure: THEOCHEM, Vol. 363, Núm. 3, pp. 319-331
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Theoretical studies of possible processes for the interstellar production of phosphorus compounds: The reaction of P+ with C3H2
Journal of Physical Chemistry, Vol. 100, Núm. 35, pp. 14643-14650
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Theoretical studies of simple organoboron compounds: Structures and stabilities of BC2H4 isomers
Applied Organometallic Chemistry, Vol. 10, Núm. 3-4, pp. 283-295
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Theoretical study of the C3P radical and its cation
Journal of Physical Chemistry, Vol. 100, Núm. 2, pp. 585-593
1995
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Ionization and protonation of (MgCN): an ab initio study of some gas-phase properties of the first magnesium compound in space
Journal of Molecular Structure: THEOCHEM, Vol. 336, Núm. 1, pp. 29-37
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Theoretical studies of possible processes for the interstellar production of phosphorus compounds. The reaction of P+ with acetylene
Journal of Physical Chemistry, Vol. 99, Núm. 17, pp. 6432-6440