Facultad de Química

2006

1. 2D supramolecular assemblies of benzene-1,3,5-triyl-tribenzoic acid: Temperature-induced phase transformations and hierarchical organization with macrocyclic molecules

   Journal of the American Chemical Society, Vol. 128, Núm. 49, pp. 15644-15651

2. A TDDFT study of the excited states of DNA bases and their assemblies

   Journal of Physical Chemistry B, Vol. 110, Núm. 14, pp. 7129-7138

3. A convenient method for epichlorohydrin determination in water using headspace-solid-phase microextraction and gas chromatography

   Journal of Chromatographic Science, Vol. 44, Núm. 7, pp. 438-443

4. A metal-free approach to the synthesis of indoline derivatives by a phenyliodine(III) bis(trifluoroacetate)-mediated amidohydroxylation reaction

   Journal of Organic Chemistry, Vol. 71, Núm. 21, pp. 8316-8319

5. A new approach for the two-electron cumulant in natural orbital functional theory

   International Journal of Quantum Chemistry, Vol. 106, Núm. 5, pp. 1093-1104

6. A physically meaningful method for the comparison of potential energy functions

   Journal of Computational Chemistry, Vol. 27, Núm. 2, pp. 238-252

7. A simple asymmetric organocatalytic approach to optically active cyclohexenones

   Chemical Communications, pp. 4928-4930

8. A study of the coordination shell of aluminum(III) and magnesium(II) in model protein environments: Thermodynamics of the complex formation and metal exchange reactions

   Journal of Inorganic Biochemistry, Vol. 100, Núm. 3, pp. 374-384

9. A study of the use of oscillatory flow to characterize isotactic and syndiotactic poly(propylene)s

   Macromolecular Chemistry and Physics, Vol. 207, Núm. 19, pp. 1781-1788

10. A thermodynamic approach to the fragility of glass-forming polymers

    Journal of Chemical Physics, Vol. 124, Núm. 2

11. A universal parameter for silicon anisotropic etching in alkaline solutions

    Proceedings of the IEEE International Conference on Micro Electro Mechanical Systems (MEMS)

12. Ab initio calculation of the anomalous Hall conductivity by Wannier interpolation

    Physical Review B - Condensed Matter and Materials Physics, Vol. 74, Núm. 19

13. Ab initio study of the nonlinear optics of III-V semiconductors in the terahertz regime

    Physical Review B - Condensed Matter and Materials Physics, Vol. 74, Núm. 24

14. Activation of methane by the iron dimer cation. A theoretical study

    Journal of Physical Chemistry A, Vol. 110, Núm. 45, pp. 12501-12511

15. An activated equivalent of lactide toward organocatalytic ring-opening polymerization

    Journal of the American Chemical Society, Vol. 128, Núm. 51, pp. 16442-16443

16. An advantageous synthesis of new indazolone and pyrazolone derivatives

    Tetrahedron, Vol. 62, Núm. 48, pp. 11100-11105

17. Analogies and differences between two ways to evaluate the global hardness

    Journal of Chemical Physics, Vol. 125, Núm. 24

18. Anisotropic etching of silicon as a tool for creating injection molding tooling surfaces

    Journal of Microelectromechanical Systems, Vol. 15, Núm. 6, pp. 1671-1680

19. Anomalous dynamic arrest in a mixture of large and small particles

    Physical Review E - Statistical, Nonlinear, and Soft Matter Physics, Vol. 74, Núm. 2

20. Análisis de la eficiencia de nucleación de diversos agentes en la policaprolactona

    Revista de la Facultad de Ingenieria, Vol. 21, Núm. 3, pp. 105-119