Departamento de Química Física

2014

1. A theoretical study of ternary indole-cation-anion complexes

   Organic and Biomolecular Chemistry, Vol. 12, Núm. 45, pp. 9145-9156

2. Accounting for conformational flexibility and torsional anharmonicity in the H + CH3CH2OH hydrogen abstraction reactions: A multi-path variational transition state theory study

   Journal of Chemical Physics, Vol. 140, Núm. 17

3. Adaptándose a una nueva filosofía europea de educación universitaria: la experiencia "Cocina a conCiencia" y las competencias transversales para el alumnado del Grado en Química

   FECIES 2013: X Foro Internacional sobre Evaluación de la Calidad de la Investigación y de la Educación Superior

4. Advanced non-invasive fluorescence spectroscopy and imaging for mapping photo-oxidative degradation in acrylonitrile-butadiene-styrene: A study of model samples and of an object from the 1960s

   Polymer Degradation and Stability, Vol. 107, pp. 356-365

5. Anomalous and planar Nernst effects in thin films of the half-metallic ferromagnet La2/3Sr1/3MnO3

   Physical Review B - Condensed Matter and Materials Physics, Vol. 90, Núm. 10

6. Basis sets for the evaluation of van der Waals complex interaction energies: Ne-N2 intermolecular potential and microwave spectrum

   Journal of Computational Chemistry, Vol. 35, Núm. 3, pp. 199-203

7. Beyond the molecular orbital conception of electronically excited states through the quantum theory of atoms in molecules

   Physical Chemistry Chemical Physics, Vol. 16, Núm. 20, pp. 9249-9258

8. Biomimetismo molecular: discurso inaugural lido na solemne apertura do curso académico 2014-2015

   Santiago de Compostela : Universidade de Santiago de Compostela, Servizo de Publicacións e Intercambio Científico, D.L. 2014

9. COMMENTING THE PHYSICAL MEANING OF USUAL ELECTRONEGATIVITY SCALES

   EDULEARN14: 6TH INTERNATIONAL CONFERENCE ON EDUCATION AND NEW LEARNING TECHNOLOGIES

10. Cage-like effect in Au-Pt nanoparticle synthesis in microemulsions: A simulation study corres

    Physical Chemistry Chemical Physics, Vol. 16, Núm. 36, pp. 19720-19731

11. Calculation of the two-dimensional non-separable partition function for two molecular systems

    Journal of Molecular Modeling, Vol. 20, Núm. 4

12. Cation⋯π interaction and microhydration effects in complexes formed by pyrrolidinium cation and aromatic species in amino acid side chains

    Organic and Biomolecular Chemistry, Vol. 12, Núm. 18, pp. 2938-2949

13. Characterization and cytotoxicity studies on liposome-hydrophobic magnetite hybrid colloids

    Journal of Colloid and Interface Science, Vol. 425, pp. 118-127

14. Characterization of carbon nanotube dispersions in solutions of bile salts and derivatives containing aromatic substituents

    Journal of Physical Chemistry B, Vol. 118, Núm. 4, pp. 1012-1021

15. Combinación de Aprendizaje Cooperativo e Individual en una Asignatura de Química de Materiales

    Formación Universitaria, Vol. 7, Núm. 4, pp. 39-46

16. Control on titania nanostructure by combining block copolymer assisted sol-gel synthesis with rapid flux solvent atmosphere treatment

    European Polymer Journal, Vol. 59, pp. 270-281

17. Copper clusters as novel fluorescent probes for the detection and photocatalytic elimination of lead ions

    Physical Chemistry Chemical Physics, Vol. 16, Núm. 48, pp. 26427-26430

18. Coupling of carbon and peptide nanotubes

    Journal of the American Chemical Society, Vol. 136, Núm. 6, pp. 2484-2491

19. Critical size range of sub-nanometer au clusters for the catalytic activity in the hydrogen oxidation reaction

    Journal of the Electrochemical Society, Vol. 161, Núm. 7

20. Crystal structure of a head-to-head bis(cholic)-urea dimer

    18TH INTERNATIONAL ELECTRONIC CONFERENCE ON SYNTHETIC ORGANIC CHEMISTRY