Highly active copper-ceria and copper-ceria-titania catalysts for methanol synthesis from CO2 J Graciani, K Mudiyanselage, F Xu, AE Baber, J Evans, SD Senanayake, ... Science 345 (6196), 546-550, 2014 | 1320 | 2014 |
Water-gas shift reaction on a highly active inverse CeOx/Cu (111) catalyst: unique role of ceria nanoparticles JA Rodriguez, J Graciani, J Evans, JB Park, F Yang, D Stacchiola, ... Angew. Chem., Int. Ed 48 (43), 8047-8050, 2009 | 348 | 2009 |
Importance of the metal–oxide interface in catalysis: In situ studies of the water–gas shift reaction by ambient‐pressure X‐ray photoelectron spectroscopy K Mudiyanselage, SD Senanayake, L Feria, S Kundu, AE Baber, ... Angewandte Chemie 125 (19), 5205-5209, 2013 | 345 | 2013 |
Gold, Copper, and Platinum Nanoparticles Dispersed on CeOx/TiO2(110) Surfaces: High Water-Gas Shift Activity and the Nature of the Mixed-Metal Oxide at the … JB Park, J Graciani, J Evans, D Stacchiola, SD Senanayake, L Barrio, ... Journal of the American Chemical Society 132 (1), 356-363, 2010 | 308 | 2010 |
High Water−Gas Shift Activity in TiO2(110) Supported Cu and Au Nanoparticles: Role of the Oxide and Metal Particle Size JA Rodríguez, J Evans, J Graciani, JB Park, P Liu, J Hrbek, JF Sanz The Journal of Physical Chemistry C 113 (17), 7364-7370, 2009 | 294 | 2009 |
CO Oxidation on Inverse CeOx/Cu(111) Catalysts: High Catalytic Activity and Ceria-Promoted Dissociation of O2 F Yang, J Graciani, J Evans, P Liu, J Hrbek, JF Sanz, JA Rodriguez Journal of the American Chemical Society 133 (10), 3444-3451, 2011 | 286 | 2011 |
High catalytic activity of Au/CeOx/TiO2 (110) controlled by the nature of the mixed-metal oxide at the nanometer level JB Park, J Graciani, J Evans, D Stacchiola, S Ma, P Liu, A Nambu, ... Proceedings of the National Academy of Sciences 106 (13), 4975-4980, 2009 | 279 | 2009 |
Coumarin derivatives for dye sensitized solar cells: a TD-DFT study R Sánchez-de-Armas, MA San Miguel, J Oviedo, JF Sanz Physical Chemistry Chemical Physics 14 (1), 225-233, 2012 | 227 | 2012 |
Effect of on-site Coulomb repulsion term on the band-gap states of the reduced rutile (110) surface CJ Calzado, NC Hernández, JF Sanz Physical Review B—Condensed Matter and Materials Physics 77 (4), 045118, 2008 | 198 | 2008 |
Real-Time TD-DFT Simulations in Dye Sensitized Solar Cells: The Electronic Absorption Spectrum of Alizarin Supported on TiO2 Nanoclusters R Sánchez-de-Armas, J Oviedo Lopez, M A. San-Miguel, JF Sanz, ... Journal of Chemical Theory and Computation 6 (9), 2856-2865, 2010 | 190 | 2010 |
Frequency dependent hyperpolarizabilities with application to formaldehyde and methyl fluoride JE Rice, RD Amos, SM Colwell, NC Handy, J Sanz The Journal of chemical physics 93 (12), 8828-8839, 1990 | 177 | 1990 |
N doping of TiO2 (110): photoemission and density-functional studies A Nambu, J Graciani, JA Rodriguez, Q Wu, E Fujita, J Fdez Sanz The Journal of chemical physics 125 (9), 2006 | 170 | 2006 |
Cu, Ag, and Au atoms adsorbed on TiO2(110): cluster and periodic calculations L Giordano, G Pacchioni, T Bredow, JF Sanz Surface science 471 (1), 21-31, 2001 | 170 | 2001 |
Comparative Study on the Performance of Hybrid DFT Functionals in Highly Correlated Oxides: The Case of CeO2 and Ce2O3 J Graciani, AM Marquez, JJ Plata, Y Ortega, NC Hernandez, A Meyer, ... Journal of chemical theory and computation 7 (1), 56-65, 2011 | 152 | 2011 |
Inverse oxide/metal catalysts in fundamental studies and practical applications: A perspective of recent developments JA Rodriguez, P Liu, J Graciani, SD Senanayake, DC Grinter, ... The Journal of Physical Chemistry Letters 7 (13), 2627-2639, 2016 | 141 | 2016 |
Direct vs indirect mechanisms for electron injection in dye-sensitized solar cells R Sánchez-de-Armas, J Oviedo, MÁ San Miguel, JF Sanz The Journal of Physical Chemistry C 115 (22), 11293-11301, 2011 | 140 | 2011 |
Local character of magnetic coupling in ionic solids IPR Moreira, F Illas, CJ Calzado, J Fernández Sanz, JP Malrieu, ... Physical Review B-Condensed Matter and Materials Physics 59 (10), 6593-6596, 1999 | 138* | 1999 |
N Doping of Rutile TiO2 (110) Surface. A Theoretical DFT Study J Graciani, LJ Álvarez, JA Rodriguez, JF Sanz The Journal of Physical Chemistry C 112 (7), 2624-2631, 2008 | 136 | 2008 |
Density Functional Theory Study of the Interaction of Cu, Ag, and Au Atoms with the Regular CeO2 (111) Surface MM Branda, NC Hernández, JF Sanz, F Illas The Journal of Physical Chemistry C 114 (4), 1934-1941, 2010 | 129 | 2010 |
Au↔ N synergy and N-doping of metal oxide-based photocatalysts J Graciani, A Nambu, J Evans, JA Rodriguez, JF Sanz Journal of the American Chemical Society 130 (36), 12056-12063, 2008 | 126 | 2008 |