Universidad Nacional de Educación a Distancia » LAUNIVERSIDAD » Facultades y Escuelas » Facultad de Ciencias » Personal Docente » EVA MARIA FERNANDEZ SANCHEZ » EVA MARIA FERNANDEZ SANCHEZ

Docencia
Publicaciones
Participaciones en Proyectos
Premios
Curriculum vitae (pdf)
Curriculum vitae abreviado (pdf)
Principal
________________________ ________________________
Volver al Departamento

PUBLICACIONES

Valor del índice de Hirsch: 16 Número de Citas: 1413 (20-03-2019)

  1. Size Dependent H2 Adsorption on AlnRh+ (n = 1–12) Clusters.
    M. Jia, J. Vanbuel, P. Ferrari, E. M. Fernández, S. Gewinner, W. Schöllkopf, M. T. NGuyen, A. Fieclicke y E. Janssens
    J. Phys. Chem. C, 122, 18247 - 18255. 2018.

  2. Hydrogen chemisorption on singly vanadium doped aluminum clusters
    J. Vanbuel, E. M. Fernández, P. Ferrari, S. Gewinner, W. Schöllkopf, L. C Balbás, A. Fielicke y E. Janssens
    Chemmistry - A European Journal 23, 5638, (2017).

  3. Multiple adsorption of molecular oxygen on small Au/Pd cationic clusters at finite temperature. A van der Waals density functional study.
    E. M. Fernández y L. C. Balbás
    The Journal of Chemical Physics 144, 224308 (2016).

  4. Mesoscopic Hamiltonian for the fluctuations of adsorbed Lennard-Jones liquid films.
    E. M. Fernández, E. Chacón, L. G. Macdowell y P. Tarazona
    Physical Review E 91, 062404 (2015).

  5. The effect of dispersion forces on the capillary wyaves fluctuations of liquid surfaces.
    E. Chacón, E. M. Fernández y P. Tarazona
    Physical Review E 89, 042406 (2014).

  6. Trends in hydrodesulfurization catalysis based on realistic surface models.
    P. G. Moses; L. C. Grabow; E. M. Fernández; B. Hinnemann; H. Topsøe; K. G. Knudsen; J. K. Nørskov
    Catalysis Letters, 144, 1425 (2014).

  7. Intrinsic Fluid Interfaces and Nonlocality.
    E. M. Fernández, E. Chacón, P. Tarazona , A. O. Parry y C. Rascón
    Physical Review Letters 111, 096104 (2013).

  8. Adsorption of H, H2, and H2O inside and outside of (M@Si16F)6 tubelike aggregates and wires (M = V, Ta). A first principles study.
    H. Cantera-López, E. M. Fernández, L. C. Balbás and G. Borstel
    Materials Chemistry and Physics 139, 247 (2013).

  9. Capillary wave spectrum at adsorbed liquid films.
    E. M. Fernández, E. Chacón and P. Tarazona
    Physical review B 85, 085401 (2012).

  10. Thickness and fluctuations of free and adsorbed liquid films.
    E. M. Fernández, E. Chacón y P. Tarazona
    Physical review B 84, 205435 (2011).

  11. GGA versus van der Waals Density Functional results for mixed Gold/Mercury molecules and pure Au and Hg clusters properties.
    E. M. Fernández y L. C. Balbás
    Physical Chemistry Chemical Physics 13, 20863-20870 (2011).

  12. Universal transition state scaling relations for hydrogenation and dehydrogenation over transition metals.
    S. Wang, V. Petzold, V., J. Kleis, J. G. Howal, E. Skúlason, E. M. Fernandez, B. Hvolbæk, G. Jones, A. Toftelund, H. Falsig, M. Björketun, F. Studt, F. Abild-Pedersen, J. Rossmeisl, J. K. Nørskov y T. Bligaard.
    Physical Chemistry Chemical Physics 13, 20760-20765 (2011).

  13. First principles calculation of the structural and electronic properties of [Ti@Si16]n, [Sc@Si16K]n, and [V@Si16F]n (n < 9) aggregates formed from M@Si16 superatoms (M = Sc−, Ti, V+).
    M. B. Torres, E. M. Fernández y L. C. Balbás
    The Journal of Physical Chemistry C 115, 335-350 (2011).

  14. Theoretical study of the structural and electronic properties of aggregates, wires, and bulk phases formed from M@Si16 superatoms (M = Sc−, Ti, V+).
    M. B. Torres, E. M. Fernández y L. C. Balbás
    International Journal of Quantum Chemistry111, 444-462, (2011).

  15. First principles study of CO adsorption-CO2 desorption mechanisms on oxidized doped gold cationic clusters MAunOm+ (M = Ti, Fe; n = 1, 4-7; m =1-2).
    E. M. Fernández, M. B. Torres y L. C. Balbás
    International Journal of Quantum Chemistry 111, 510-519 (2011).

  16. Trends in the formation of aggregates and crystals from M@Si16 clusters: a study from first principle calculations.
    G. Lopez Laurrabaquio, M. B. Torres, E. M. Fernández y L. C. Balbás
    Journal of mathematical chemistry, 48, 109-117, (2010).

  17. Comparative study of the surface layer density of liquid surfaces.
    E. Chacón, E. M. Fernández, D. Duque, R. Delgado-Buscaloni y P. Tarazona
    Physical review B, 80, 195403-11 (2009).

  18. Optical Absorption Spectra of Ag11 Isomers: First-Principles Theoretical Spectroscopy with Time-dependent Density Functional Theory.
    J. I. Martinez y E. M. Fernández
    European Physical Journal D 52, 199-202 (2009).

  19. Theoretical study of the coadsorption of CO and O2 on doped cationic gold clusters.
    E. M. Fernández, M. B. Torres y L. C. Balbás
    European Physical Journal D, 52, 135-138 (2009).

  20. Theoretical study of oxygen adsorption on pure Aun+1+ and doped MAun+ cationic gold clusters for M = Ti, Fe, and n = 3-7.
    M. B. Torres, E. M. Fernández y L. C. Balbás
    The Journal of Physical Chemistry A 112, 6678-6689 (2008).

  21. Scaling Relationships for Adsorption Energies on Transition Metal Oxide, Sulphide, and Nitride Surfaces.
    E. M. Fernández, P. G. Moses, A. Toftelund, H. A. Hansen, J. I. Martinez, F. Abild-Pedersen, J. Kleis, B. Hinnemann, J. Rossmeisl, T. Bligaard y J. K. Nørskov
    Angewandte Chemie Int. Ed. 47, 4683-4686 (2008).

  22. Structure and relative stability Sin, Sin-, and doped SinM clusters (M=Sc-, Ti, V+) in the range n=14-18.
    M. B. Torres, E. M. Fernández y L. C. Balbás
    Journal of Computational Methods in Sciences and Engineering 7, 241 (2007).

  23. Theoretical study of isolectronic SinM clusters (M=Sc-, Ti, V+; n=14-18).
    M. B. Torres, E. M. Fernández y L. C. Balbás
    Physical Review B 75, 205435 (2007).

  24. Ab initio calculations of H2O and O2 adsorption on Al2O3 substrates.
    E. M. Fernández, R. Eglitis, G. Borstel y L. C. Balbás
    Computational Materials Science 39, 587-592 (2007).

  25. Planar and cagelike structure of gold clusters: Density-functional pseudopotential Calculations.
    E. M. Fernández, J. M. Soler y L. C. Balbás
    Physical Review B 73, 235433-8 (2006).

  26. Theoretical study of CO adsorption on Au/alumina substrates.
    E. M. Fernández y L. C. Balbás
    Journal of Physical Chemistry: B110,10449-10454 (2006).

  27. Theoretical study of CO adsorption on Au/alumina substrates.
    E. M. Fernández y L. C. Balbás
    Physica status solidi A203, 1277-1283 (2006).

  28. Density functional studies of noble metal clusters. Adsorption of O2 and CO on gold and silver clusters.
    E. M. Fernández, M. B. Torres y L. C. Balbás
    In Recent Advances in the Theory of Chemical and Physical Systems; Julien, J.-P.; Maruani, J.; Mayou, D.; Wilson, S.; Delgado-Barrio, G. (eds.), Progress in Theoretical Chemistry and Physics, 407-432 (2006) (Capítulo de Libro).

  29. Theoretical study of O2 and CO adsorption on Aun clusters (n=5-10).
    E. M. Fernández, Ordejón y L. C. Balbás
    Chemical Physics Letters 408, 252-257 (2005).

  30. Structural properties of bimetallic clusters from density functional calculations.
    E. M. Fernández, L. A. Pérez, K. Michaelian, L. C. Balbás and I. L. Garzón
    International Journal of Modern Physics B 19, 15-17 (2005).

  31. Theoretical study of structural, electronic, and magnetic properties of AunTM+ doped clusters (TM = Sc, Ti, V, Cr, Mn, Fe, Au; n ≤ 9).
    M. B. Torres, E. M. Fernández y L. C. Balbás
    Physical Review B 71, 155412-8 (2005).

  32. Density functional study of the stability and magnetic behaviour of AunTM+ clusters (TM= Au, Sc, Ti, V, Cr, Mn, Fe 1 ك n  ك 9).
    M. B. Torres, E. M. Fernández and L. C. Balbás 
    Physica status solidi B  242,  819-821 (2005).

  33. Adsorption and dissociation of water on non ideal surface of alumina: a first principles study.
    E. M. Fernández, R. Eglitis, G. Borstel y L. C. Balbás
    Physica status solidi B 242, 807-809 (2005).

  34. Trends in the structure and bonding of neutral and charged noble metal clusters.
    E. M. Fernández, J. M. Soler, I. L. Garzón and L. C. Balbás
    International Journal of Quantum Chemistry  101, 740-745 (2005).

  35. Trends in the structure and bonding of noble metal clusters.
    E. M. Fernández, J. M. Soler, I. L. Garzón and L. C. Balbás
    Physical Review B, 70, 165303-14 (2004).

  36. Trends in the Binding of the First-Row Transition Metal Compounds: V(001) Surface, TM- Oxide and Nitride Molecules and AunTi (2كn ك7) Clusters.
    E. M. Fernández; M. B. Torres and L. C. Balbás 
    International Journal of Quantum Chemistry 99, 39-46 (2003).

  37. Study of (Al2O3)n(Ox) clusters with n ≤ 16 and x = 0,1,2 from first principles calculation.
    E. M. Fernández, G. Borstel, J. M. Soler y L. C. Balbás
    European Physical Journal D 24, 245-148 (2003).

  38. First principles calculation of the geometric and electronic structure of (Al2O3)n(Ox)  clusters with n < 15 and x=0,1,2.
    E. M. Fernández, G. Borstel, J. M. Soler y L. C. Balbás
    Thin Solid Films 428, 206-210  (2003).