A DFT study of the stoichiometric and reduced anatase (001) surfaces
ORTEGA, Yanaris, HEVIA, Daniel Fernández, OVIEDO, J, SAN-MIGUEL, M. A
Published in Applied surface science (01.03.2014)
Published in Applied surface science (01.03.2014)
Get full text
Journal Article
Electronic structure, optical and sonophotocatalytic properties of spindle-like CaWO4 microcrystals synthesized by the sonochemical method
de Sousa, P.B., Gouveia, A.F., Sczancoski, J.C., Nogueira, I.C., Longo, E., San-Miguel, M.A., Cavalcante, L.S.
Published in Journal of alloys and compounds (25.02.2021)
Published in Journal of alloys and compounds (25.02.2021)
Get full text
Journal Article
Experimental and molecular dynamics simulation analysis of LaCrO3 precipitation in chromia scales
PAUL, A, ODRIOZOLA, J. A, SAN MIGUEL, M. A, FERNANDEZ SANZ, J, ALVAREZ, L. J
Published in Acta materialia (30.06.2000)
Published in Acta materialia (30.06.2000)
Get full text
Journal Article
Structure, optical properties, and photocatalytic activity of α-Ag2W0.75Mo0.25O4
Penha, M.D., Gouveia, A.F., Teixeira, M.M., de Oliveira, R.C., Assis, M., Sambrano, J.R., Yokaichya, F., Santos, C.C., Gonçalves, R.F., Siu Li, M., San-Miguel, M.A., Andrés, J., Longo, E.
Published in Materials research bulletin (01.12.2020)
Published in Materials research bulletin (01.12.2020)
Get full text
Journal Article
Direct vs. indirect mechanisms for electron injection in DSSC: Catechol and alizarin
Sánchez-de-Armas, R., San-Miguel, M.A., Oviedo, J., Sanz, J. Fdez
Published in Computational and theoretical chemistry (15.11.2011)
Published in Computational and theoretical chemistry (15.11.2011)
Get full text
Journal Article
A theoretical study of the Na-TiO2 (001) rutile interaction
JIMENEZ CALZADO, C, OVIEDO, J, SAN MIGUEL, M. A, FERNANDEZ SANZ, J
Published in Journal of molecular catalysis. A, Chemical (23.05.1997)
Published in Journal of molecular catalysis. A, Chemical (23.05.1997)
Get full text
Conference Proceeding
Journal Article
Theoretical study of the Fluorine doped anatase surfaces
Ortega, Yanaris, Lamiel-Garcia, Oriol, Hevia, Daniel Fernandez, Tosoni, Sergio, Oviedo, Jaime, San-Miguel, Miguel Angel, Illas, Francesc
Published in Surface science (01.12.2013)
Published in Surface science (01.12.2013)
Get full text
Journal Article
Lithium diffusion in gamma -LiAlO sub 2 , a molecular dynamics simulation
Jacobs, J-P, San Miguel, M A, Alvarez, L J, Bosch Giral, P
Published in Journal of nuclear materials (15.09.1996)
Get full text
Published in Journal of nuclear materials (15.09.1996)
Journal Article
On the origin of the reconstruction of LaAlO3 {100} surfaces
JACOBS, J.-P, SAN MIGUEL, M. A, SANCHEZ-SANCHEZ, J. E, ALVAREZ, L. J
Published in Surface science (06.11.1997)
Published in Surface science (06.11.1997)
Get full text
Journal Article
Ba adsorption on the TiO2 (110) surface. A density functional study
San Miguel, M.A., Oviedo, J., Sanz, J.F.
Published in Journal of molecular structure. Theochem (14.09.2006)
Published in Journal of molecular structure. Theochem (14.09.2006)
Get full text
Journal Article
Predicting chiral discrimination in HPLC from computer simulations
Lukač, Renato, Clark, Andrew J., San-Miguel, Miguel A., Rodger, alison, Rodger, P.Mark
Published in Journal of molecular liquids (01.11.2002)
Published in Journal of molecular liquids (01.11.2002)
Get full text
Journal Article