44 citations · 44 across the 2 of their papers we have counts for
2 papers
cond-mat.mtrl-sci2020
Structural Transition in Oxidized CaN Electrenes: CaO/CaN 2D heterostructures
Pedro H. Souza, José E. Padilha, Roberto H. Miwa
Based on first-principles calculations we show that the oxidation of ultrathin films of CaN electrides, electrenes, drives a hexagonaltetragonal structural transit…
cond-mat.mes-hall2010★ 44 cited
Energetics and stability of vacancies in carbon nanotubes
José Eduardo Padilha, Rodrigo Garcia Amorim, Alexandre Reily Rocha +2
In this work we present ab initio calculations of the formation energies and stability of different types of multi-vacancies in carbon nanotubes. We demonstrate that, as in the cas…