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Relation between structural patterns and magnetism in small iron oxide clusters: reentrance of the magnetic moment at high oxidation ratios

Aguilera del Toro, Rodrigo Humberto ; Aguilera Granja, Juan Faustino; Torres Cabrera, María Begoña; Vega Hierro, Andrés (2021)
Li-decorated BC3 nanopores: Promising materials for hydrogen storage

Cabria Álvaro, Iván ; Lebon, Alexandre; Torres Cabrera, María Begoña; Gallego del Hoyo, Luis Javier; Vega Hierro, Andrés (2024)
Structural and electronic changes in the Ni13@Ag42 nanoparticle under surface oxidation: the role of silver coating

Aguilera del Toro, Rodrigo Humberto ; Aguilera Granja, Juan Faustino; Vega Hierro, Andrés (2024)
Why are Zn-rich Zn–Mg nanoalloys optimal protective coatings against corrosion? A first-principles study of the initial stages of the oxidation process

Álvarez Zapatero, Pablo ; Lebon, Alexandre; Aguilera del Toro, Rodrigo Humberto ; Aguado Rodríguez, Andrés ; Vega Hierro, Andrés (2021)
Ab initio study of lithium decoration of popgraphene and hydrogen storage capacity of the hybrid nanostructure

Vega Hierro, Andrés ; Gallego del Hoyo, Luis Javier; Lebon, Alexandre; Álvarez Zapatero, Pablo; Herrero, Andrés (2021)