164 citations · 222 across the 15 of their papers we have counts for
15 papers
First principles calculations of electric-field-driven topological phase transitions in silicene, germanene and stanene
Julián Antonio Villarreal Murúa, Pablo Roura-Bas, Javier Daniel Fuhr +1
The emergence of two-dimensional topological materials, particularly the group-14 monolayers known as silicene, germanene, and stanene has opened promising pathways for next-genera…
Discovering atomistic pathways for supply of metal atoms to graphene surface from methyl-based precursors
D. G. Sangiovanni, R. Faccio, G. K. Gueorguiev +1
Conceptual 2D group III nitrides and oxides (e.g., 2D InN and 2D InO) in heterostructures with graphene have been realized by metalorganic chemical vapor deposition (MOCVD). MOCVD…
Vibrational Properties of the Bi2Se3 Orthorhombic Metastable Phase
Paloma B. Souza, Milton A. Tumelero, Ricardo Faccio +4
Chalcogenides materials are being considered as some of the most promising systems for energy harvesting and energy conversion. Among them, the orthorhombic family of compounds X2Y…
Ab-initio approach to the stability and the structural, electronic and magnetic properties of the (001) Znfe2O4 surface terminations
Karen L. Salcedo Rodríguez, Jhon J. Melo Quintero, Hugo H. Medina +6
We present a Density Functional Theory (DFT) based study of the structural and magnetic properties of the (001) surface of the semiconducting oxide ZnFe2O4 (spinel structure). The…
Stability and magnetism in complex multivacancy graphene systems
Ricardo Faccio, Alvaro W. Mombrú
This work is focused in the stability and magnetic properties of complex graphene multivacancy systems, studied by Density Functional Theory calculations. The removal of a sequence…
Stability of multivacancies in graphene
Ricardo Faccio, Alvaro W. Mombrú
The stability of graphene multivacancy systems is studied using Density Functional Theory (DFT) calculations. This work describes the evolution of the energy of formation per carbo…