Centro
FAC CIENCIAS
Publicaciones (286) Publicaciones en las que ha participado algún/a investigador/a
2017
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Structure and Dynamics in Formamide-(H
2
O)
3
: A Water Pentamer Analogue
Journal of Physical Chemistry Letters, Vol. 8, Núm. 24, pp. 6060-6066
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A Case Study of Thiourea-Assisted Iminium Formation by Hydroxyl Anion Binding: Kinetic, Spectroscopic and Computational Evidences
Advanced Synthesis and Catalysis, Vol. 359, Núm. 23, pp. 4122-4128
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A Comprehensive Rotational Study of Interstellar Iso-propyl Cyanide up to 480 GHz
Astrophysical Journal, Supplement Series, Vol. 233, Núm. 2
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A DFT + U study on structural, electronic, vibrational and thermodynamic properties of TiO2 polymorphs and hydrogen titanate: Tuning the hubbard ‘U-term’
Journal of Physics Communications, Vol. 1, Núm. 5
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A DFT-Based Computational-Experimental Methodology for Synthetic Chemistry: Example of Application to the Catalytic Opening of Epoxides by Titanocene
Journal of Organic Chemistry, Vol. 82, Núm. 7, pp. 3760-3766
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A Modular Approach to Inorganic Phosphazane Macrocycles
Angewandte Chemie - International Edition, Vol. 56, Núm. 31, pp. 9087-9090
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A Thermodynamic Study of Aqueous 1-Allyl-3-Methylimidazolium Formate Ionic Liquid as a Tailored Sorbent for Carbon Dioxide Separation
Energy Technology, Vol. 5, Núm. 8, pp. 1464-1471
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A butterfly motion of formic acid and cyclobutanone in the 1:1 hydrogen bonded molecular cluster
Physical Chemistry Chemical Physics, Vol. 19, Núm. 1, pp. 204-209
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A context for the last Neandertals of interior Iberia: Los Casares cave revisited
PLoS ONE, Vol. 12, Núm. 7
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A fast bioanalytical method based on microextraction by packed sorbent and UPLC–MS/MS for determining new psychoactive substances in oral fluid
Talanta, Vol. 174, pp. 454-461
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A new zenith-looking narrow-band radiometer-based system (ZEN) for dust aerosol optical depth monitoring
Atmospheric Measurement Techniques, Vol. 10, Núm. 2, pp. 565-579
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A non-chiral lithium aluminate reagent for the determination of enantiomeric excess of chiral alcohols
Chemical Communications, Vol. 53, Núm. 7, pp. 1225-1228
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A physically based model for resistive memories including a detailed temperature and variability description
Microelectronic Engineering, Vol. 178, pp. 26-29
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A purification postulate for quantum mechanics with indefinite causal order
Quantum, Vol. 1
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A qualitative study of a nanotube model using an iterative Taylor method
International Journal of Modern Physics C, Vol. 28, Núm. 3
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A second-order numerical method for a cell population model with asymmetric division
Journal of Computational and Applied Mathematics, Vol. 309, pp. 522-531
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A spectral method for an Optimal Investment problem with transaction costs under Potential Utility
Journal of Computational and Applied Mathematics, Vol. 319, pp. 262-276
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Ab initio study of several static and dynamic properties of bulk liquid Ni near melting
Journal of Chemical Physics, Vol. 146, Núm. 3
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Accurate Experimental (p, ρ, T) Data for the Introduction of Hydrogen into the Natural Gas Grid: Thermodynamic Characterization of the Nitrogen-Hydrogen Binary System from 240 to 350 K and Pressures up to 20 MPa
Journal of Chemical and Engineering Data, Vol. 62, Núm. 12, pp. 4310-4326
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Accurate atomic data for Galactic Surveys
Proceedings of the International Astronomical Union, Vol. 12, Núm. S330, pp. 203-205