NTARGET STATES: Difference between revisions
No edit summary |
|||
(3 intermediate revisions by the same user not shown) | |||
Line 19: | Line 19: | ||
[[Category:INCAR tag]][[Category:Wannier | [[Category:INCAR tag]][[Category:Wannier functions]][[Category:Many-body perturbation theory]][[Category:Constrained-random-phase approximation]] |
Latest revision as of 08:55, 21 February 2024
NTARGET_STATES = [integer array]
Description: Controls which Wannier states are excluded in constrained random phase approximation. Check also NCRPA_BANDS.
This tag is effective for ALGO=CRPA and ignored otherwise. For instance
NTARGET_STATES = 1 2 4
selects the Wannier state 1, 2 and 4, where the ordering of the Wannier states depends on the chosen basis set.