Skip to content

Add grouping option to `DipoleAngle` module

Philip Loche requested to merge dipangle_grouping into main

Adding an grouping option to choose how the atoms should be grouped when calculating the DipoleAngle timeseries.

Also the options "atoms" was missing the docstring for the grouping option.

I realized that we miss the option when discussing the issues in #124 (closed).

Merge request reports