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Issue DateTitleAuthor(s)
6-Aug-2021Chemical ordering in Pt-Au, Pt-Ag and Pt-Cu nanoparticles from density functional calculations using a topological approachVega Dominguez, Lorena; Aleksandrov, Hristiyan A.; Farris, Riccardo; Bruix, Albert; Viñes Solana, Francesc; Neyman, Konstantin M.
11-Mar-2022Nanostructuring 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.
2021AgPd, AuPd, and AuPt nanoalloys with Ag- or Au-rich compositions: Modeling chemical ordering and optical propertiesDanielis, Nicola; Vega Dominguez, Lorena; Fronzoni, Giovanna; Stener, Mauro; Bruix, Albert; Neyman, Konstantin M.
2022Quantifying interactions on interfaces between metal partic¬les and oxide supports in catalytic nanomaterialsNeyman, Konstantin M.; Kozlov, Sergey
22-Dec-2021Unravelling Morphological and Topological Energy Contributions of Metal NanoparticlesVega Dominguez, Lorena; Viñes Solana, Francesc; Neyman, Konstantin M.
6-Mar-2023States of Pt/CeO2 catalysts for CO oxidation below room temperature.Slavinskaya, Elena M.; Stadnichenko, Andrey I.; Quinlivan Domínguez, Jon E.; Stonkus, Olga A.; Vorokhta, M.; míd, Břetislav; Castro-Latorre, Pablo; Bruix, Albert; Neyman, Konstantin M.; Boronin, Andrei I.
7-Jan-2021Pd single-atom sites on the surface of PdAu nanoparticles: A DFT-based Topological search for suitable compositionsMamatkulov, Mikhail; Yudanov, Ilya; Bukhtiyarov, Andrey V.; Neyman, Konstantin M.
24-Jan-2021CO oxidation activity of Pt/CeO2 catalysts below 0ºC: Platinum loading effectsBoronin, A.I.; Slavinskaya, E.M.; Figueroba Sánchez, Alberto; Stadnichenko, A.I.; Kardash, T.Yu.; Stonkus, O.A.; Fedorova, E.A.; Muravev, V.V.; Svetlichnyi, V.A.; Bruix Fusté, Albert; Neyman, Konstantin M.
2022Stability of oxidized states of free-standing and ceria-supported PtOx particlesQuinlivan Domínguez, Jon E.; Neyman, Konstantin M.; Bruix, Albert