Química Física y Química Inorgánica
Departamento
Luca
Evangelisti
Publicaciones en las que colabora con Luca Evangelisti (46)
2025
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Exploring the conformational landscape through rotational spectroscopy and computational modelling: The tunneling dynamics in 2,6-diethylphenol
Spectrochimica Acta - Part A: Molecular and Biomolecular Spectroscopy, Vol. 324
2024
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A Rotational Study of 2-tert-Butylphenol and Its 1 : 1 Argon Complex
ChemPhysChem, Vol. 25, Núm. 11
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Molecular structure and internal dynamics of the antioxidant 2,6-di-tert-butylphenol
Journal of Molecular Structure, Vol. 1296
2023
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A Competition between Relative Stability and Binding Energy in Caffeine Phenyl-Glucose Aggregates: Implications in Biological Mechanisms
International Journal of Molecular Sciences, Vol. 24, Núm. 5
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Rotational Spectroscopy Probes Lone Pair···π-Hole Interactions in Hexafluorobenzene-Tertiary Alkylamines Complexes
Journal of Physical Chemistry Letters, Vol. 14, Núm. 23, pp. 5335-5342
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The Structure of 2,6-Di-tert-butylphenol–Argon by Rotational Spectroscopy
Molecules, Vol. 28, Núm. 24
2022
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Competition between In-Plane vs Above-Plane Configurations of Water with Aromatic Molecules: Non-Covalent Interactions in 1,4-Naphthoquinone-(H2O)1-3Complexes
Journal of Physical Chemistry Letters, Vol. 13, Núm. 40, pp. 9510-9516
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Hydrogen Bonding in the Dimer and Monohydrate of 2-Adamantanol: A Test Case for Dispersion-Corrected Density Functional Methods
Molecules (Basel, Switzerland), Vol. 27, Núm. 8
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Probing intra- and inter-molecular interactions through rotational spectroscopy: The case of the odorant 2'-aminoacetophenone and its 1:1 water and neon complexes
The Journal of chemical physics, Vol. 157, Núm. 14, pp. 144303
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Structure and dynamics of methacrylamide, a computational and free-jet rotational spectroscopic study
Journal of Molecular Structure, Vol. 1248
2021
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Characterizing hydrogen and tetrel bonds in clusters of CO2with carboxylic acids
Physical Chemistry Chemical Physics, Vol. 23, Núm. 31, pp. 16915-16922
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Characterizing the lone pair⋯π-hole interaction in complexes of ammonia with perfluorinated arenes
Physical Chemistry Chemical Physics, Vol. 23, Núm. 15, pp. 9121-9129
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The Role of Non-Covalent Interactions on Cluster Formation: Pentamer, Hexamers and Heptamer of Difluoromethane
Angewandte Chemie - International Edition, Vol. 60, Núm. 31, pp. 16894-16899
2020
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Chlorination and tautomerism: A computational and UPS/XPS study of 2-hydroxypyridine ⇌ 2-pyridone equilibrium
Physical Chemistry Chemical Physics, Vol. 22, Núm. 24, pp. 13440-13455
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Millimeter wave free-jet spectrum of acrolein and several isotopologues
Canadian Journal of Physics, Vol. 98, Núm. 6, pp. 555-559
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Millimeter wave free-jet spectrum of the isotopologues of 1,2-butanediol
Journal of Molecular Structure, Vol. 1205
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Structural Changes Induced by Quinones: High-Resolution Microwave Study of 1,4-Naphthoquinone
ChemPhysChem, Vol. 21, Núm. 23, pp. 2579-2584
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The Six Isomers of the Cyclohexanol Dimer: A Delicate Test for Dispersion Models
Angewandte Chemie, Vol. 132, Núm. 33, pp. 14185-14189
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The Six Isomers of the Cyclohexanol Dimer: A Delicate Test for Dispersion Models
Angewandte Chemie - International Edition, Vol. 59, Núm. 33, pp. 14081-14085
2019
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A General Treatment to Study Molecular Complexes Stabilized by Hydrogen-, Halogen-, and Carbon-Bond Networks: Experiment and Theory of (CH2F2)n⋅⋅⋅(H2O)m
Angewandte Chemie - International Edition, Vol. 58, Núm. 25, pp. 8437-8442