10 citations · 23 across the 6 of their papers we have counts for
3 papers · 2 filters
First-principles approach to Non-Collinear Magnetism: towards Spin-dynamics
S. Sharma, J. K. Dewhurst, C. Ambrosch-Draxl +6
A description of non-collinear magnetism in the framework of spin-density functional theory is presented for the exact exchange energy functional which depends explicitly on two-co…
All-electron Exact Exchange Treatment of Semiconductors: Effect of Core-valence Interaction on Band-gap and -band Position
S. Sharma, J. K. Dewhurst, C. Ambrosch-Draxl
Exact exchange (EXX) Kohn-Sham calculations within an all-electron full-potential method are performed on a range of semiconductors and insulators (Ge, GaAs, CdS, Si, ZnS, C, BN, N…
Magnetism in Exact Exchange Density Functional Theory
S. Sharma, J. K. Dewhurst, C. Persson +3
The magnetic properties of the intermetallic compound FeAl are investigated using exact exchange density functional theory. This is implemented within a state of the art all-electr…