116 citations · 219 across the 5 of their papers we have counts for
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Universal scaling of the electronic and the elastic energies of small polarons revealed by high-throughput first-principles calculations
Fei Zhou, Babak Sadigh, Daniel Aberg
Formation of self-trapped holes (STH) in a comprehensive list of scintillator materials, including halides and chalcogenides, are studied using an accurate and computationally effi…
Constituents of magnetic anisotropy and a screening of spin-orbit coupling in solids
Vladimir Antropov, Liqin Ke, Daniel Åberg
Using quantum mechanical perturbation theory (PT) we analyze how the energy of perturbation of different orders is renormalized in solids. We test the validity of PT analysis by co…
Pressure-induced phase transition in the electronic structure of palladium nitride
Daniel Åberg, Paul Erhart, Jonathan Crowhurst +3
We present a combined theoretical and experimental study of the electronic structure and equation of state (EOS) of crystalline PdN2. The compound forms above 58 GPa in the pyrite…
Intrinsic point defects in aluminum antimonide
Daniel Åberg, Paul Erhart, Andrew J. Williamson +1
Calculations within density functional theory on the basis of the local density approximation are carried out to study the properties of intrinsic point defects in aluminum antimon…
Extrinsic point defects in aluminum antimonide
Paul Erhart, Daniel Åberg, Vincenzo Lordi
We investigate thermodynamic and electronic properties of group IV (C, Si, Ge, Sn) and group VI (O, S, Se, Te) impurities as well as P and H in aluminum antimonide (AlSb) using fir…