Closed Andrew-S-Rosen closed 3 days ago
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Summary of Changes
As noted in https://github.com/Quantum-Accelerators/quacc/issues/1887, the VASP recipes are the only ones throughout quacc with
relax_cell = True
by default (namely:relax_job
andase_relax_job
). This can lead to unexpected behavior for users that run multiple codes in quacc. To streamline things, eventually we will makerelax_cell = False
by default. This would be a notable breaking change, so we will not do so for some time. The warning may be perceived as annoying, but it is perhaps worthwhile.Requirements
main
.Notes