NTARGET_STATES

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Revision as of 15:57, 7 April 2022 by Karsai (talk | contribs)

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.

Related tags and articles

ALGO, NCRPA_BANDS

Examples that use this tag