64 citations · 77 across the 2 of their papers we have counts for
2 papers
cond-mat.mtrl-sci2014★ 13 cited
Characterization of the nitrogen split interstitial defect in wurtzite aluminum nitride using density functional theory
A. Szállás, K. Szász, X. T. Trinh +3
We carried out Heyd-Scuseria-Ernzerhof hybrid density functional theory plane wave supercell calculations in wurtzite aluminum nitride in order to characterize the geometry, format…
cond-mat.str-el2014★ 64 cited
Theoretical unification of hybrid-DFT and DFT+U methods for the treatment of localized orbitals
Viktor Ivády, Rickard Armiento, Krisztián Szász +3
We formulate the on-site occupation dependent exchange correlation energy and effective potential of hybrid functionals for localized states and connect them to the on-site correct…