Closed brainandforce closed 1 year ago
Patch coverage: 60.00
% and project coverage change: -0.23
:warning:
Comparison is base (
a4c702a
) 49.36% compared to head (831d35f
) 49.13%.:exclamation: Current head 831d35f differs from pull request most recent head c3191c4. Consider uploading reports for the commit c3191c4 to get more accurate results
:umbrella: View full report in Codecov by Sentry.
:loudspeaker: Do you have feedback about the report comment? Let us know in this issue.
I've converted
RealBasis
andReciprocalBasis
to using bohr as the default length unit (and rad*bohr⁻¹ for inverse length). By default, energy units are assumed to be in Hartree. (Packages like VASP that don't use Hartree atomic units by default have their inputs converted to match the package's conventions)