[Pw_forum] cut-off energy doesnt optimized
project way
project.way95 at gmail.com
Fri May 5 13:16:13 CEST 2017
Dear QE users
I am running ZnO bulk scf for different cut-off energy but Etot didnt
optimized.
Ecut= 40 Etot=-317.466 Ry
Ecut= 50 Etot=-317.484 Ry
Ecut= 60 Etot=-317.492 Ry
Ecut= 75 Etot=-317.493 Ry
for optimization with 0.0001 i should increase Ecut too much?
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