ANTONIO
LARGO CABRERIZO
CATEDRATICOS DE UNIVERSIDAD
MARIA CARMEN
BARRIENTOS BENITO
CATEDRATICOS DE UNIVERSIDAD
Publicacións nas que colabora con MARIA CARMEN BARRIENTOS BENITO (123)
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
2023
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Structure, spectroscopic signatures, and formation of hydroxy-azirine: a potential interstellar prebiotic molecule
Monthly Notices of the Royal Astronomical Society, Vol. 520, Núm. 2, pp. 1659-1671
2022
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Computational study on the affinity of potential drugs to SARS-CoV-2 main protease
Journal of Physics Condensed Matter, Vol. 34, Núm. 29
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Structure and Spectroscopic Signatures of Interstellar Sodium Isocyanate Isomers
Astrophysical Journal, Vol. 941, Núm. 1
2020
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Amino acetaldehyde conformers: Structure and spectroscopic properties
Monthly Notices of the Royal Astronomical Society, Vol. 492, Núm. 2, pp. 1827-1833
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Formation of interstellar cyanoacetamide: A rotational and computational study
Astronomy and Astrophysics, Vol. 644
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Structure and Spectroscopic Properties of Hydrocalcium Isocyanide Isomers: Plausible Astronomical Ca-bearing Molecules
Astrophysical Journal, Vol. 899, Núm. 2
2019
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Alkaline and alkaline-earth cyanoacetylides: A combined theoretical and rotational spectroscopic investigation
Journal of Chemical Physics, Vol. 151, Núm. 5
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Formation of protonated glycine isomers in the interstellar medium
ACS Earth and Space Chemistry, Vol. 3, Núm. 7, pp. 1170-1181
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Spectroscopic parameters of HTiCN/HTiNC: New titanium compounds of astrochemical interest
Astrophysical Journal, Vol. 871, Núm. 2
2018
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Computational study of the formation of prebiotic molecules in the interstellar medium through gas-phase reactions
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY
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Structural Trends in Monoboronyl Compounds: Analysis of the Interaction of Second-Row Elements with BO
Journal of Physical Chemistry A, Vol. 122, Núm. 1, pp. 398-409
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Structure and spectroscopic properties of imine acetaldehyde: A possible interstellar molecule
Monthly Notices of the Royal Astronomical Society, Vol. 478, Núm. 3, pp. 3042-3048
2017
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Complex Organic Molecules Formation in Space Through Gas Phase Reactions: A Theoretical Approach
Astrophysical Journal, Vol. 836, Núm. 2
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Metallic monoboronyl compounds: Prediction of their structure and comparison with the cyanide analogues
Journal of Computational Chemistry, Vol. 38, Núm. 11, pp. 807-815
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Prebiotic molecules formation through the gas-phase reaction between HNO and CH 2 CHOH 2 +
Astronomy and Astrophysics, Vol. 603
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Structure and Spectroscopic Properties of [Mg,C,N,O] Isomers: Plausible Astronomical Molecules
ACS Earth and Space Chemistry, Vol. 1, Núm. 3, pp. 158-167
2016
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Metallic cyanoacetylides of copper, silver and gold: Generation and structural characterization
Physical Chemistry Chemical Physics, Vol. 18, Núm. 41, pp. 28538-28547
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Molecular Structure and Bonding in Plutonium Carbides: A Theoretical Study of PuC3
Journal of Physical Chemistry A, Vol. 120, Núm. 14, pp. 2232-2239
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PREDICTION of the SPECTROSCOPIC PARAMETERS of NEW IRON COMPOUNDS: HYDRIDE of IRON CYANIDE/ISOCYANIDE, HFeCN/HFeNC
Astrophysical Journal, Vol. 828, Núm. 1