Disciplina temàtica
Química
Publicacions (290) Publicacions en què ha participat algun/a investigador/a
2015
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3-(Pyridin-2-yl)imidazo[1,5-a]pyridine (Pyridylindolizine) as Ligand in Complexes of Transition and Main-Group Metals
European Journal of Inorganic Chemistry, Vol. 2015, Núm. 29, pp. 4921-4934
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7-endo selenocyclization reactions on chiral 3-prenyl and 3-cinnamyl-2-hydroxymethylperhydro-1,3-benzoxazine derivatives. A way to enantiopure 1,4-oxazepanes
Organic and Biomolecular Chemistry, Vol. 13, Núm. 34, pp. 9118-9126
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A DFT approach to the charge transport related properties in columnar stacked π-conjugated N-heterocycle cores including electron donor and acceptor units
Physical Chemistry Chemical Physics, Vol. 17, Núm. 1, pp. 605-618
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A chronoamperometric screen printed carbon biosensor based on alkaline phosphatase inhibition for W(IV) determination in water, using 2-phospho-L-ascorbic acid trisodium salt as a substrate
Sensors (Switzerland), Vol. 15, Núm. 2, pp. 2232-2243
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A continuous process for the production of a fabric reinforced polymeric matrix
Journal of Reinforced Plastics and Composites, Vol. 34, Núm. 20, pp. 1662-1672
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A density functional theory insight towards the rational design of ionic liquids for SO2 capture
Physical Chemistry Chemical Physics, Vol. 17, Núm. 20, pp. 13559-13574
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A detailed study of cholinium chloride and levulinic acid deep eutectic solvent system for CO2capture via experimental and molecular simulation approaches
Physical Chemistry Chemical Physics, Vol. 17, Núm. 32, pp. 20941-20960
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A robust hybrid algorithm (neural networks-AGDC) applied to non-isothermal kinetics of consecutive chemical reactions
Journal of Mathematical Chemistry, Vol. 53, Núm. 4, pp. 1080-1104
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A semiclassical treatment of the ℓ-j correlation in atom-diatom collisions
Journal of Chemical Physics, Vol. 143, Núm. 6
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A theoretical study on mitigation of CO2 through advanced deep eutectic solvents
International Journal of Greenhouse Gas Control, Vol. 39, pp. 62-73
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AUTOFIT, an automated fitting tool for broadband rotational spectra, and applications to 1-hexanal
Journal of Molecular Spectroscopy, Vol. 312, pp. 13-21
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Accurate Time-Dependent Wave Packet Calculations for the O+ + H2 → OH+ + H Ion-Molecule Reaction
Journal of Physical Chemistry A, Vol. 119, Núm. 50, pp. 11951-11962
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Accurate equilibrium structures for piperidine and cyclohexane
Journal of Physical Chemistry A, Vol. 119, Núm. 9, pp. 1486-1493
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Accurate spectroscopy of polycyclic aromatic compounds: From the rotational spectrum of fluoren-9-one in the millimeter wave region to its infrared spectrum
Journal of Chemical Physics, Vol. 142, Núm. 2
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Acrylic Polymers with Pendant Phenylboronic Acid Moieties as "turn-Off" and "turn-On" Fluorescence Solid Sensors for Detection of Dopamine, Glucose, and Fructose in Water
ACS Macro Letters, Vol. 4, Núm. 9, pp. 979-983
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Acrylic acid (CH 2CHCOOH): The rotational spectrum in the millimetre range up to 397 GHz
Molecular Physics, Vol. 113, Núm. 15-16, pp. 2290-2295
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Activity and stability studies of platinized multi-walled carbon nanotubes as fuel cell electrocatalysts
Applied Catalysis B: Environmental, Vol. 162, pp. 289-299
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Adenosine monophosphate is elevated in the bronchoalveolar lavage fluid of mice with acute respiratory toxicity induced by nanoparticles with high surface hydrophobicity
Nanotoxicology, Vol. 9, Núm. 1, pp. 106-115
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Adsorption of choline benzoate ionic liquid on graphene, silicene, germanene and boron-nitride nanosheets: a DFT perspective
Physical Chemistry Chemical Physics, Vol. 17, Núm. 25, pp. 16315-16326
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Adsorptive removal of pharmaceuticals from water by commercial and waste-based carbons
Journal of Environmental Management, Vol. 152, pp. 83-90