NCRPA BANDS: Difference between revisions
(Fix {{TAG|ALGO|CRPA}}; hyphenate "random-phase"; blank line before heading; remove trailing ----) |
(Remove deprecated ---- before categories) |
||
| Line 16: | Line 16: | ||
{{sc|NCRPA_BANDS|Howto|Workflows that use this tag}} | {{sc|NCRPA_BANDS|Howto|Workflows that use this tag}} | ||
[[Category:INCAR tag]][[Category:Many-body perturbation theory]][[Category:Constrained-random-phase approximation]] | [[Category:INCAR tag]][[Category:Many-body perturbation theory]][[Category:Constrained-random-phase approximation]] | ||
Latest revision as of 09:57, 20 March 2026
NCRPA_BANDS = [integer array]
Description: Controls which bands are excluded in the constrained random-phase approximation. Check also NTARGET_STATES.
This tag is effective for ALGO = CRPA and ignored otherwise.
For instance
NCRPA_BANDS = 21 22 23
removes all screening effects between bands 21, 22 and 23 from the constrained random-phase approximation of the screened Coulomb interaction.