Henning Janssen

In the `atomGroup` section of the `inp.xml` all of the tags from the `species` can occur overriding the tags set on the species (version constraint?) This should be included in...

Todos for plotting methods after fleur workshop

3

These things I plan to work on for the plotting methods but probably won't get to till after the fleur workshop: - [x] matplotlib has a similar capability to bokeh...

The size of these files can be reduced a lot. Some ideas: - [x] Filter out empty entries dicts, lists, etc.

Here care must be taken with ambiguouities

One thing that the schema dictionaries cannot handle period is renaming of tags and attributes. It might be nice if there would be an aliasing mechanism, where in one central...

Implement unified way of checking dimensions, exporting and unifying data for plots

2

The current way of providing data for plots in the plot_methods is through arrays or lists. The dimension checking is quite fragile and also varies from method to method (both...