MIGUEL
CARVAJAL ZAERA
CATEDRATICO DE UNIVERSIDAD
Publications (82) Publications de MIGUEL CARVAJAL ZAERA
2024
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Degeneracy in excited-state quantum phase transitions of two-level bosonic models and its influence on system dynamics
Physical Review A, Vol. 109, Núm. 6
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Insights into the mechanism, selectivity, and substituent effects in the Diels-Alder reaction of azatrienes with electron-rich dienophiles: An MEDT study
Journal of Molecular Graphics and Modelling, Vol. 132
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New SiS destruction and formation routes via neutral-neutral reactions and their fundamental role in interstellar clouds at low- and high-metallicity values
Astronomy and Astrophysics, Vol. 687
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Revisiting the massive star-forming complex RCW 122: New millimeter and submillimeter study
Astronomy and Astrophysics, Vol. 689
2023
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A Spectroscopic Description of Asymmetric Isotopologues of CO2
Journal of Physical Chemistry A, Vol. 127, Núm. 31, pp. 6357-6376
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Observations and Chemical Modeling of the Isotopologues of Formaldehyde and the Cations of Formyl and Protonated Formaldehyde in the Hot Molecular Core G331.512-0.103
Astrophysical Journal, Vol. 953, Núm. 1
2022
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Algebraic vibrational description of the symmetric isotopologues of CO2: 13C16O2, 12C18O2 and 12C17O2
Chemical Physics, Vol. 557
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Anharmonicity-induced excited-state quantum phase transition in the symmetric phase of the two-dimensional limit of the vibron model
Physical Review A, Vol. 105, Núm. 3
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Quantum fidelity susceptibility in excited state quantum phase transitions: Application to the bending spectra of nonrigid molecules
SciPost Physics, Vol. 12, Núm. 1, pp. 1-28
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The Si + SO2 collision and an extended network of neutral–neutral reactions between silicon and sulphur bearing species
Monthly Notices of the Royal Astronomical Society, Vol. 515, Núm. 1, pp. 369-377
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Theoretical Spectroscopic Study of Two Ketones of Atmospheric Interest: Methyl Glyoxal (CH3COCHO) and Methyl Vinyl Ketone (CH3COCH═CH2)
Journal of Physical Chemistry A, Vol. 126, Núm. 40, pp. 7230-7241
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Theoretical spectroscopic study of acetyl (CH3CO), vinoxy (CH2CHO), and 1-methylvinoxy (CH3COCH2) radicals. Barrierless formation processes of acetone in the gas phase
Open Research Europe, Vol. 1
2021
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Excited state quantum phase transitions in the bending spectra of molecules
Journal of Quantitative Spectroscopy and Radiative Transfer, Vol. 261
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Isocyanic acid (HNCO) in the hot molecular core G331.512-0.103: Observations and chemical modelling
Monthly Notices of the Royal Astronomical Society, Vol. 504, Núm. 3, pp. 4428-4444
2020
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An algebraic alternative for the accurate simulation of CO2 Raman spectra
Journal of Raman Spectroscopy, Vol. 51, Núm. 3, pp. 569-583
2019
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New Spectral Characterization of Dimethyl Ether Isotopologues CH 3 OCH 3 and 13 CH 3 OCH 3 in the THz Region
Astrophysical Journal, Supplement Series, Vol. 241, Núm. 1
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Ab initio spectroscopic characterization of the radical CH3OCH2 at low temperatures
Journal of Chemical Physics, Vol. 150, Núm. 19
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Calculation of Transition State Energies in the HCN-HNC Isomerization with an Algebraic Model
Journal of Physical Chemistry A, Vol. 123, Núm. 44, pp. 9544-9551
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Competitive Gas Phase Reactions for the Production of Isomers C2O2H4. Spectroscopic Constants of Methyl Formate
Journal of Physical Chemistry A, Vol. 123, Núm. 45, pp. 9658-9668
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Impact of nonconvergence and various approximations of the partition function on the molecular column densities in the interstellar medium
Astronomy and Astrophysics, Vol. 627