QUÍMICA FÍSICA

2018

1. Non-intuitive rotational reorientation in collisions of NO(A 2 Σ + ) with Ne from direct measurement of a four-vector correlation

   Nature Chemistry, Vol. 10, Núm. 11, pp. 1148-1153

2. A Ring Polymer Molecular Dynamics Approach to Study the Transition between Statistical and Direct Mechanisms in the H2 + H3+ → H3+ + H2 Reaction

   Journal of Physical Chemistry Letters, Vol. 9, Núm. 9, pp. 2133-2137

3. Angular momentum-scattering angle quantum correlation: A generalized deflection function

   Chemical Science, Vol. 9, Núm. 21, pp. 4837-4850

4. Application of a robust hybrid algorithm (Neural Networks-AGDC) for the determination of kinetic parameters and discrimination among reaction mechanisms

   Match, Vol. 79, Núm. 3, pp. 619-644

5. Collisional cooling of internal rotation in MgH+ ions trapped with He atoms: Quantum modeling meets experiments in Coulomb crystals

   Physical Review A, Vol. 98, Núm. 5

6. Crystal structure, Hirshfeld surfaces computational study and physicochemical characterization of the hybrid material (C7H10N)2[SnCl6]·H2O

   Journal of Molecular Structure, Vol. 1152, pp. 276-286

7. Diastereoselective synthesis of 7,8-carvone epoxides

   Catalysts, Vol. 8, Núm. 6

8. Diastereoselective synthesis of chiral 1,3-cyclohexadienals

   PLoS ONE, Vol. 13, Núm. 2

9. Effect of pressure on the gasification of dodecane with steam and supercritical water and consequences for H2 production

   Journal of Materials Chemistry A, Vol. 6, Núm. 4, pp. 1671-1681

10. Hyperfine structure of 2 Σ molecules containing alkaline-earth-metal atoms

    Physical Review A, Vol. 97, Núm. 4

11. Influence of iron doping on the photocatalytic activity of nanocrystalline TiO2 particles fabricated by ultrasound method for enhanced degradation of organic dye

    Journal of Materials Science: Materials in Electronics, Vol. 29, Núm. 7, pp. 6019-6031

12. Innovación en la enseñanza de física y química: aprender haciendo

    Innovar en las aulas: modelos y experiencias de innovación educativa en el Máster de Profesorado de Educación Secundaria, Bachillerato, Formación Profesional y Enseñanza de Idioma (Ediciones Universidad de Salamanca), pp. 37-50

13. Metastable phase in binary and ternary 12-carat gold alloys at low temperature

    Materials Research Express, Vol. 5, Núm. 4

14. Modeling Quantum Kinetics in Ion Traps: State-changing Collisions for OH+(3Σ-) Ions with He as a Buffer Gas

    ChemPhysChem, Vol. 19, Núm. 15, pp. 1866-1875

15. Preparation, molecular structure, vibrational and photoluminescence study of a novel compound based chlorocadmate (II) material

    Journal of Molecular Structure, Vol. 1165, pp. 42-50

16. Rotational ‘cooling’ and ‘heating’ of OH+(3Σ−) by collisions with He: quantum dynamics revealing propensity rules under ion trap conditions †

    Molecular Physics, Vol. 116, Núm. 19-20, pp. 2686-2697

17. Sev and pcu topological nets in one-pot newly synthesized mixed-ligand imidazole-containing Cu(II) coordination frameworks: Crystal structure, intermolecular interactions, theoretical calculations, magnetic behavior and biological activity

    Inorganica Chimica Acta, Vol. 478, pp. 59-70

18. Structure characterization, photoluminescence and dielectric properties of a new hybrid compound containing chlorate anions of zincate (II)

    Journal of Molecular Structure, Vol. 1158, pp. 221-228

19. Supercritical regeneration of an activated carbon fiber exhausted with phenol

    Applied Sciences (Switzerland), Vol. 8, Núm. 1

20. Synthesis, crystal structure and characterization of a new organic–inorganic hybrid material 4-(ammonium methyl) pipyridinium hexachloro stanate (II) trihydrate

    Journal of Molecular Structure, Vol. 1155, pp. 536-547