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Issue Date | Title | Author(s) |
---|---|---|
1-Mar-2016 | Towards stable single-atom catalysts: Strong binding of atomically dispersed transition metals on the surface of nanostructured ceria | Figueroba Sánchez, Alberto; Kovács, Gábor; Bruix Fusté, Albert; Neyman, Konstantin M. |
6-Aug-2021 | Chemical ordering in Pt-Au, Pt-Ag and Pt-Cu nanoparticles from density functional calculations using a topological approach | Vega Dominguez, Lorena; Aleksandrov, Hristiyan A.; Farris, Riccardo; Bruix, Albert; Viñes Solana, Francesc; Neyman, Konstantin M. |
11-Mar-2022 | Nanostructuring determines poisoning: Tailoring CO adsorption on PtCu bimetallic nanoparticles. | Vega Dominguez, Lorena; García Cardona, Julia; Viñes Solana, Francesc; Cabot Julià, Pere-Lluís; Neyman, Konstantin M. |
28-Jul-2017 | Size dependent structural and polymorphic transitions in ZnO: from nanocluster to bulk | Viñes Solana, Francesc; Lamiel Garcia, Josep Oriol; Illas i Riera, Francesc; Bromley, Stefan Thomas |
4-Feb-2019 | Subsurface carbon: a general feature of noble metals | Piqué, Oriol; Koleva, Iskra Z.; Viñes Solana, Francesc; Aleksandrov, Hristiyan A.; Vayssilov, Georgi N.; Illas i Riera, Francesc |
15-Nov-2021 | Adsorption and oxidation of CO on ceria nanoparticles exposing single-atom Pd and Ag: A DFT modelling | Nasluzov, Vladimir A.; Ivanova Shor, Elena A.; Shor, Aleksey M.; Laletina, Svetlana A.; Neyman, Konstantin M. |
13-Feb-2020 | Explaining Cu@Pt bimetallic nanoparticles activity based on NO adsorption | Viñes Solana, Francesc; Görling, Andreas |
1-Aug-2016 | Effect of size and structure on the ground-state and excited-state electronic structure of TiO2 nanoparticles | Cho, Daeheum; Ko, Kyoung Chul; Lamiel Garcia, Josep Oriol; Bromley, Stefan Thomas; Lee, Jin Yong; Illas i Riera, Francesc |
1-Apr-2017 | When anatase nanoparticles become bulk-like: properties of realistic TiO2 nanoparticles in the 1-6 nm size range from all electron relativistic density functional theory based calculations | Lamiel Garcia, Josep Oriol; Ko, Kyoung Chul; Lee, Jin Yong; Bromley, Stefan Thomas; Illas i Riera, Francesc |
2022 | Quantifying interactions on interfaces between metal partic¬les and oxide supports in catalytic nanomaterials | Neyman, Konstantin M.; Kozlov, Sergey |
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