Departamento
Departamento de Química Física
Artículos (48) Publicaciones en las que ha participado algún/a investigador/a
2012
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A DFT study of the interaction between microhydrated anions and naphthalendiimides
ChemPhysChem, Vol. 13, Núm. 2, pp. 570-577
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A MP2 and DFT study of the influence of complexation on the aromatic character of phosphole
Journal of Molecular Modeling, Vol. 18, Núm. 2, pp. 765-770
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A QTAIM-based energy partitioning for understanding the physical origin of conformational preferences: Application to the Z effect in O=C-X-R and related units
Journal of Computational Chemistry, Vol. 33, Núm. 32, pp. 2533-2543
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A computational study of anion-modulated cation-π interactions
Journal of Physical Chemistry B, Vol. 116, Núm. 20, pp. 5860-5871
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A model for monomer and micellar concentrations in surfactant solutions: Application to conductivity, NMR, diffusion, and surface tension data
Journal of Colloid and Interface Science, Vol. 370, Núm. 1, pp. 102-110
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Ab initio ground state phenylacetylene-argon intermolecular potential energy surface and rovibrational spectrum
Journal of Chemical Physics, Vol. 137, Núm. 7
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Ab initio ground- and excited-state intermolecular potential energy surfaces for the NO-Ne and NO-Ar van der Waals complexes
Journal of Physical Chemistry A, Vol. 116, Núm. 27, pp. 7319-7328
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Accurate calculation of the intensity dependence of the refractive index using polarized basis sets
Journal of Chemical Physics, Vol. 136, Núm. 2
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Acrylic protective coatings modified with titanium dioxide nanoparticles: Comparative study of stability under irradiation
Polymer Degradation and Stability, Vol. 97, Núm. 11, pp. 2136-2142
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Adsorption of paraquat on soil organic matter: Effect of exchangeable cations and dissolved organic carbon
Journal of Hazardous Materials, Vol. 235-236, pp. 218-223
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Boosting Lewis Acid Catalysis in Water-in-Oil Metallomicroemulsions
ChemCatChem, Vol. 4, Núm. 12, pp. 1979-1986
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Calixarene-based surfactants: Conformational-dependent solvation shells for the alkyl chains
ChemPhysChem, Vol. 13, Núm. 9, pp. 2368-2376
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Calixarene-based surfactants: Evidence of structural reorganization upon micellization
Langmuir, Vol. 28, Núm. 5, pp. 2404-2414
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Characterization of poly(2-hydroxyethyl methacrylate) (PHEMA) contact lens using the Langmuir monolayer technique
Journal of Colloid and Interface Science, Vol. 385, Núm. 1, pp. 202-210
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Comparison of arsenate, chromate and molybdate binding on schwertmannite: Surface adsorption vs anion-exchange
Journal of Colloid and Interface Science, Vol. 386, Núm. 1, pp. 338-343
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Directional freezing of liquid crystalline systems: From silver nanowire/PVA aqueous dispersions to highly ordered and electrically conductive macroporous scaffolds
Journal of Materials Chemistry, Vol. 22, Núm. 18, pp. 9195-9201
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Effects of microhydration on the characteristics of cation-phenol complexes
Theoretical Chemistry Accounts, Vol. 131, Núm. 11, pp. 1-13
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Energy transfer and thermal accommodation in ozone scattering from a perfluorinated self-assembled monolayer
Journal of Physical Chemistry C, Vol. 116, Núm. 48, pp. 25454-25464
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Evidence of higher complexes between cucurbit[7]uril and cationic surfactants
Chemistry - A European Journal, Vol. 18, Núm. 25, pp. 7931-7940
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Formation of tubules by p-tert-butylphenylamide derivatives of chenodeoxycholic and ursodeoxycholic acids in aqueous solution
Steroids, Vol. 77, Núm. 12, pp. 1205-1211