[QE-users] Preserve space group during relaxation

Dr. Sheharyar Pervez Assistant Professor FES sheharyar at giki.edu.pk
Thu Jun 5 22:58:17 CEST 2025


Hello,

I know that cell_dofree='ibrav' will keep the lattice consistent. But is there any way to keep the space_group consistent as well? Or will cell_dofree take care of that as well?

Thank you.
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