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Issue Date
Title
Author(s)
2012
Molecular dynamics simulation of the spherical electrical double layer of a soft nanoparticle. Effect of the surface and counterion valence
Nedyalkova, Miroslava; Madurga Díez, Sergio; Pisov, Stoyan; Pastor, Isabel; Vilaseca i Font, Eudald; Mas i Pujadas, Francesc
26-May-2017
Surface composition changes of CuNi-ZrO2 catalysts during methane decomposition: An operando NAP-XPS and density functional study
Wolfbeisser, Astrid; Kovács, Gábor; Kozlov, Sergey; Föttinger, Karin; Bernardi, Johannes; Klötzer, Bernhard; Neyman, Konstantin M.; Rupprechter, Günther
16-Nov-2016
Effects of electron transfer in model catalyst composed of Pt nanoparticles on CeO2(111) surface
Kozlov, Sergey; Neyman, Konstantin M.
6-Feb-2015
Energetic stability of absorbed H in Pd and Pt nanoparticles in a more realistic environment
Kozlov, Sergey; Aleksandrov, Hristiyan A.; Neyman, Konstantin M.
19-Aug-2015
Towards 4th generation biomaterials: a covalent hybrid polymer-ormoglass architecture
Sachot, Nadège; Mateos-Timoneda, M. A.; Planell, J. A. (Josep Anton); Velders, A. H.; Lewandowska, Malgorzata; Engel, Elisabeth; Castaño Linares, Óscar
2-Apr-2015
How to determine accurate chemical ordering in several nanometer large bimetallic crystallites from electronic structure calculations
Kozlov, Sergey; Kovács, Gábor; Ferrando, Riccardo; Neyman, Konstantin M.
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.
16-Nov-2020
Optimizing gold nanoparticle size and shape for the fabrication of SERS substrates by means of the Langmuir-Blodgett technique
Tahghighi, Mohammad; Janner, Davide; Ignés i Mullol, Jordi
Discover
Author
15
Neyman, Konstantin M.
14
Illas i Riera, Francesc
11
Viñes Solana, Francesc
6
Bromley, Stefan Thomas
6
Kozlov, Sergey
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Subject
55
Nanoparticles
16
Density functionals
16
Teoria del funcional de densitat
7
Diòxid de titani
7
Titanium dioxide
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2022
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2021
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2018
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