Bugfix species_full_gaussian

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.

changed milestone to %14.0

added Bugfix label

assigned to @nicolastd

@martin.lueders Here comes another bugfix. This is a small one that fixes a bug I introduced roughly a year ago...

Would you mind having a look?

resolved all threads

added 1 commit

• 9c2aed31 - Fixes a bug introduced in 61160ad9 about the threshold of the Gaussian species root finder.

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added 1 commit

• 97f4f1d0 - Fixes a bug introduced in 61160ad9 about the threshold of the Gaussian species root finder.

Compare with previous version

requested review from @martin.lueders

approved this merge request

mentioned in commit f18d7914

merged

added in Changelog label