NELMGW

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Revision as of 11:05, 20 December 2021 by Huebsch (talk | contribs)

NELMGW = [integer]
Default: NELMGW = 1 

Description: Controls the number of self-consistent GW steps. Available as of 6.3.0.


This tag is effective for ALGO=EVGW[0] | QPGW[0] | GW[0][R][K] | and ignored otherwise. For instance

ALGO = EVGW0
NELMGW = 4

performs a partially self-consistent GW calculations, where is updated four times. All supported ALGO tags related to calculations are described here.

Omit NBANDS and NELM to select the single-step GW procedure.


Related Tags and Sections

ALGO

Examples that use this tag