Departamento
Departamento de Química Física
Publicaciones (79) Publicaciones en las que ha participado algún/a investigador/a
2015
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A tryptophan-substituted cholic acid: Expanding the family of labelled biomolecules
Colloids and Surfaces A: Physicochemical and Engineering Aspects, Vol. 483, pp. 142-149
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Ag2 and Ag3 Clusters: Synthesis, Characterization, and Interaction with DNA
Angewandte Chemie - International Edition, Vol. 54, Núm. 26, pp. 7612-7616
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An automated method to find transition states using chemical dynamics simulations
Journal of Computational Chemistry, Vol. 36, Núm. 4, pp. 222-234
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An automated transition state search using classical trajectories initialized at multiple minima
Physical Chemistry Chemical Physics, Vol. 17, Núm. 22, pp. 14912-14921
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An axisymmetric model for the analysis of dynamic surface tension
RSC Advances, Vol. 5, Núm. 11, pp. 7921-7931
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Applicability of medium-size basis sets in calculations of molecular dynamic polarisabilities
Molecular Physics, Vol. 113, Núm. 13-14, pp. 1786-1793
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Arsenate and phosphate adsorption on ferrihydrite nanoparticles. Synergetic interaction with calcium ions
Chemical Geology, Vol. 410, pp. 53-62
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Bile salts and derivatives: Rigid unconventional amphiphiles as dispersants, carriers and superstructure building blocks
Current Opinion in Colloid and Interface Science, Vol. 20, Núm. 3, pp. 170-182
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Composite membranes with hydrophilic nanopores derived from the self-assembly of block copolymer supramolecular complexes
European Polymer Journal, Vol. 62, pp. 108-115
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Controlling Bimetallic Nanostructures by the Microemulsion Method with Subnanometer Resolution Using a Prediction Model
Langmuir, Vol. 31, Núm. 27, pp. 7435-7439
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Copolymers with acetyl-protected thiol pendant groups as highly efficient stabilizing agents for gold surfaces
RSC Advances, Vol. 5, Núm. 18, pp. 13722-13726
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Core-Shell Nanocatalysts Obtained in Reverse Micelles: Structural and Kinetic Aspects
Journal of Nanomaterials, Vol. 2015
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DFT and Kinetic Monte Carlo Study of TMS-Substituted Ruthenium Vinyl Carbenes: Key Intermediates for Stereoselective Cyclizations
ACS Catalysis, Vol. 5, Núm. 11, pp. 6255-6262
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Effect of ionization on the behavior of n-eicosanephosphonic acid monolayers at the air/water interface. experimental determinations and molecular dynamics simulations
Langmuir, Vol. 31, Núm. 8, pp. 2269-2280
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Electronic Degeneracy and Intrinsic Magnetic Properties of Epitaxial Nb:SrTiO3 Thin Films Controlled by Defects
Physical Review Letters, Vol. 115, Núm. 16
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Epitaxial CrN Thin films with high thermoelectric figure of merit
Advanced Materials, Vol. 27, Núm. 19, pp. 3032-3037
- Equilibrio en disolución
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Excited-state proton and charge transfer in protonated amino and methylated derivatives of 2-(2′-hydroxyphenyl)benzimidazole
Journal of Physical Chemistry B, Vol. 119, Núm. 6, pp. 2475-2489
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Excluding hyperconjugation from the Z conformational preference and investigating its origin: formic acid and beyond
Physical Chemistry Chemical Physics, Vol. 17, Núm. 40, pp. 26946-26954
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Exploring the charged nature of supramolecular micelles based on p-sulfonatocalix[6]arene and dodecyltrimethylammonium bromide
Physical Chemistry Chemical Physics, Vol. 17, Núm. 39, pp. 26378-26385