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Bugfix species_full_gaussian

Nicolas Tancogne-Dejean requested to merge fix_gaussian_species_threshold into release-14.0

Description

Fixes a bug introduced in 61160ad9 about the threshold of the Gaussian species root finder. This was causing the code to not find the root for the atomic density for small grid spacing.

Checklist

  • I have checked that my code follows the Octopus coding standards
  • I have added tests for all the new features added in this request.

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