Fix bandgap_tol
and delete bandgap_override
on MPMetaGGARelaxSetGenerator
#553
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Closes #552.
ead2dbc add
BANDGAP_TOL: float = 1e-4
toAtomate2Settings
fd0109b test
ValidationError
onAtomate2Settings
with invalidVASP_CMD
andBANDGAP_TOL
606af2b delete unused
bandgap_override
parametera329639
VaspInputGenerator
passgetattr(self, "bandgap_tol", SETTINGS.BANDGAP_TOL)
to_set_kspacing
1b176d1 test passing
bandgap_tol
toMPMetaGGARelaxSetGenerator
intests/vasp/flows/test_mp.py
a9deeef test ALL incar tags in
tests/vasp/flows/test_mp.py