Centro de fisica de materiales

2006

1. 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

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

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

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

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

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

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

5. 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

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

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

7. Anti-stokes laser cooling in bulk erbium-doped materials

   Physical Review Letters, Vol. 97, Núm. 3

8. Approximate functionals from many-body perturbation theory

   Lecture Notes in Physics, Vol. 706, pp. 161-180

9. Asymptotics of the dispersion interaction: Analytic benchmarks for van der Waals energy functionals

   Physical Review Letters, Vol. 96, Núm. 7

10. Charge-density oscillations at (1 1 1) noble metal surfaces

    Surface Science, Vol. 600, Núm. 18, pp. 3875-3878

11. Chemical reduction method for industrial application of undoped polypyrrole electrodes in lithium-ion batteries

    Journal of Power Sources, Vol. 160, Núm. 1, pp. 585-591

12. Ciencia y tecnología, el tren del futuro

    Cuadernos para el diálogo, Núm. 7, pp. 106-109

13. Complexity and Fermi surface deformation in compressed lithium

    Physical Review B - Condensed Matter and Materials Physics, Vol. 74, Núm. 17

14. Conductivity enhancement in raw polypyrrole and polypyrrole nanoparticle dispersions

    Polymers for Advanced Technologies, Vol. 17, Núm. 1, pp. 26-29

15. Confined optical modes and amplified spontaneous emission from a microtube cavity formed by vacuum assisted filtration

    Applied Physics Letters, Vol. 89, Núm. 14

16. Curvature of the total electron density at critical coupling: Attractive impurity in an electron gas

    New Journal of Physics, Vol. 8

17. Definition of Systematic, Approximately Separable, and Modular Internal Coordinates (SASMIC) for macromolecular simulation

    Journal of Computational Chemistry, Vol. 27, Núm. 10, pp. 1076-1087

18. Density functionals from many-body perturbation theory: The band gap for semiconductors and insulators

    Journal of Chemical Physics, Vol. 124, Núm. 15

19. Describing the component dynamics in miscible polymer blends: Towards a fully predictive model

    Journal of Chemical Physics, Vol. 124, Núm. 15

20. Dynamic confinement effects in polymer blends. A quasielastic neutron scattering study of the dynamics of poly(ethylene oxide) in a blend with poly(vinyl acetate)

    Macromolecules, Vol. 39, Núm. 8, pp. 3007-3018