I think there is a typo
lelfield = .TURE. ,
for your convergence issue: run a calc without electric field first, then
restart by reading the charge density from file(startingpot='file') with
field turn on at a small value (you can play that game several times and
increase the value gradually)!
H
Dear QE Users,
When I relax my structure with electric field, it cannot converge in one bfgs
steps.
The estimated scf accuracy fluctuate up and down. between 0.005 and 0.038?
estimated scf accuracy< 0.00535597 Ry
estimated scf accuracy< 0.03831434 Ry
estimated s