Philippe Sautet
Philippe Sautet
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Use of DFT to achieve a rational understanding of acid–basic properties of γ-alumina surfaces
M Digne, P Sautet, P Raybaud, P Euzen, H Toulhoat
Journal of Catalysis 226 (1), 54-68, 2004
Finding optimal surface sites on heterogeneous catalysts by counting nearest neighbors
F Calle-Vallejo, J Tymoczko, V Colic, QH Vu, MD Pohl, K Morgenstern, ...
Science 350 (6257), 185-189, 2015
Hydroxyl groups on γ-alumina surfaces: a DFT study
M Digne, P Sautet, P Raybaud, P Euzen, H Toulhoat
Journal of Catalysis 211 (1), 1-5, 2002
Introducing structural sensitivity into adsorption–energy scaling relations by means of coordination numbers
F Calle-Vallejo, D Loffreda, MTM Koper, P Sautet
Nature chemistry 7 (5), 403-410, 2015
Competitive C C and C O Adsorption of α-β-Unsaturated Aldehydes on Pt and Pd Surfaces in Relation with the Selectivity of Hydrogenation Reactions: A Theoretical Approach
F Delbecq, P Sautet
Journal of Catalysis 152 (2), 217-236, 1995
Stability and Reactivity of ϵ−χ−θ Iron Carbide Catalyst Phases in Fischer−Tropsch Synthesis: Controlling μC
E de Smit, F Cinquini, AM Beale, OV Safonova, W van Beek, P Sautet, ...
Journal of the American Chemical Society 132 (42), 14928-14941, 2010
Fast prediction of adsorption properties for platinum nanocatalysts with generalized coordination numbers
F Calle‐Vallejo, JI Martínez, JM García‐Lastra, P Sautet, D Loffreda
Angewandte Chemie International Edition 53 (32), 8316-8319, 2014
Single-atom tailoring of platinum nanocatalysts for high-performance multifunctional electrocatalysis
M Li, K Duanmu, C Wan, T Cheng, L Zhang, S Dai, W Chen, Z Zhao, P Li, ...
Nature Catalysis 2 (6), 495-503, 2019
A fundamental look at electrocatalytic sulfur reduction reaction
L Peng, Z Wei, C Wan, J Li, Z Chen, D Zhu, D Baumann, H Liu, CS Allen, ...
Nature Catalysis 3 (9), 762-770, 2020
Calculation of the benzene on rhodium STM images
P Sautet, C Joachim
Chemical Physics Letters 185 (1-2), 23-30, 1991
Structure and stability of aluminum hydroxides: a theoretical study
M Digne, P Sautet, P Raybaud, H Toulhoat, E Artacho
The Journal of Physical Chemistry B 106 (20), 5155-5162, 2002
γ-Alumina: the essential and unexpected role of water for the structure, stability, and reactivity of “defect” sites
R Wischert, P Laurent, C Copéret, F Delbecq, P Sautet
Journal of the American Chemical Society 134 (35), 14430-14449, 2012
Significance of single-electron energies for the description of CO on Pt (111)
G Kresse, A Gil, P Sautet
Physical Review B 68 (7), 073401, 2003
Images of adsorbates with the scanning tunneling microscope: theoretical approaches to the contrast mechanism
P Sautet
Chemical Reviews 97 (4), 1097-1116, 1997
Semiconductors used in photovoltaic and photocatalytic devices: assessing fundamental properties from DFT
T Le Bahers, M Rerat, P Sautet
The Journal of Physical Chemistry C 118 (12), 5997-6008, 2014
Understanding palladium hydrogenation catalysts: when the nature of the reactive molecule controls the nature of the catalyst active phase
D Teschner, Z Révay, J Borsodi, M Hävecker, A Knop‐Gericke, R Schlögl, ...
Angewandte Chemie 120 (48), 9414-9418, 2008
Electronic interference produced by a benzene embedded in a polyacetylene chain
P Sautet, C Joachim
Chemical Physics Letters 153 (6), 511-516, 1988
Hydrogen adsorption on palladium: a comparative theoretical study of different surfaces
W Dong, V Ledentu, P Sautet, A Eichler, J Hafner
Surface science 411 (1-2), 123-136, 1998
Electronic transmission coefficient for the single-impurity problem in the scattering-matrix approach
P Sautet, C Joachim
Physical Review B 38 (17), 12238, 1988
Efficient method for the simulation of STM images. I. Generalized Green-function formalism
J Cerdá, MA Van Hove, P Sautet, M Salmeron
Physical Review B 56 (24), 15885, 1997
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Artículos 1–20