Centro de Nanociencia y Tecnologías Sostenibles (CNATS)

2009

1. Ab initio study of the structural stability of fcc-CHx phases

   Carbon, Vol. 47, Núm. 7, pp. 1637-1642

2. Adsorption and diffusion of water, methanol, and ethanol in all-silica DD3R: Experiments and simulation

   Journal of Physical Chemistry C, Vol. 113, Núm. 32, pp. 14290-14301

3. Can the isotropic-smectic transition of colloidal hard rods occur via nucleation and growth?

   Faraday Discussions, Vol. 144, pp. 253-269

4. Changing the physical and chemical properties of titanium oxynitrides TiN1-x Ox by changing the composition

   Physical Review B - Condensed Matter and Materials Physics, Vol. 80, Núm. 18

5. Chemical synthesis and characterization of silver-protected vasoactive intestinal peptide nanoparticles

   Nanomedicine, Vol. 4, Núm. 8, pp. 919-930

6. Columnar phases of discotics with orientation-dependent interactions

   Journal of Chemical Physics, Vol. 131, Núm. 7

7. Controlled release of phenytoin from nanostructured TiO2 reservoirs

   Science of Advanced Materials, Vol. 1, Núm. 1, pp. 63-68

8. Cooperative and noncooperative binding of *Ru(bpy)3 2+ to DNA and SB4.5G dendrimers

   Journal of Physical Chemistry B, Vol. 113, Núm. 28, pp. 9373-9378

9. Cu in In2S3: Interdiffusion phenomena analysed by high kinetic energy X-ray photoelectron spectroscopy

   Physica Status Solidi (A) Applications and Materials Science, Vol. 206, Núm. 5, pp. 1059-1062

10. Estado de Alteración de la Fachada Principal de la Iglesia de Santa Catalina (Sevilla)

    Macla: revista de la Sociedad Española de Mineralogía, Núm. 11, pp. 139-140

11. Evaluation of various water models for simulation of adsorption in hydrophobic zeolites

    Molecular Simulation, Vol. 35, Núm. 12-13, pp. 1067-1076

12. Experimental and computational studies of ZnS nanostructures

    Molecular Simulation, Vol. 35, Núm. 12-13, pp. 1015-1032

13. Experimental demonstration of the mechanism of light harvesting enhancement in Photonic-Crystal-Based Dye-Sensitized solar cells

    Journal of Physical Chemistry C, Vol. 113, Núm. 4, pp. 1150-1154

14. Identification of adsorption sites in Cu-BTC by experimentation and molecular simulation

    Langmuir, Vol. 25, Núm. 3, pp. 1725-1731

15. Incorporation and thermal evolution of rhodamine 6G Dye molecules adsorbed in porous columnar optical SiO2 thin films

    Langmuir, Vol. 25, Núm. 16, pp. 9140-9148

16. Low-coverage adsorption properties of the metal-organic framework MIL-47 studied by pulse chromatography and Monte Carlo simulations

    Physical Chemistry Chemical Physics, Vol. 11, Núm. 18, pp. 3515-3521

17. Molecular dynamics simulation of the effect of pH on the adsorption of rhodamine laser dyes on TiO2 hydroxylated surfaces

    Molecular Simulation, Vol. 35, Núm. 12-13, pp. 1140-1151

18. Molecular insights into the self-aggregation of aromatic molecules in the synthesis of nanoporous aluminophosphates: A multilevel approach

    Journal of the American Chemical Society, Vol. 131, Núm. 45, pp. 16509-16524

19. Molecular simulation study on the separation of xylene isomers in MIL-47 metal - Organic frameworks

    Journal of Physical Chemistry C, Vol. 113, Núm. 49, pp. 20869-20874

20. Numerical simulation of the current-voltage curve in dye-sensitized solar cells

    Journal of Physical Chemistry C, Vol. 113, Núm. 45, pp. 19722-19731