Showing cond-mat.mtrl-sciShow all
2 papers · 1 filter
cond-mat.mtrl-sci2007★ 32 cited
Comparison of exact-exchange calculations for solids in current-spin-density- and spin-density-functional theory
S. Sharma, S. Pittalis, S. Kurth +3
The relative merits of current-spin-density- and spin-density-functional theory are investigated for solids treated within the exact-exchange-only approximation. Spin-orbit splitti…
cond-mat.mtrl-sci2005
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…