Fix issues with `force_bound`

atomec-project / atoMEC

Python-based average-atom code for simulations of high energy density phenomena such as in warm dense matter.

https://atomec-project.github.io/atoMEC/

BSD 3-Clause "New" or "Revised" License

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Closed timcallow closed 2 years ago

timcallow commented 2 years ago

Fixes two issues:

Initializes default force_bound in config.py; required for some postprocess steps
Changes incorrect if force_bound statement in staticKS.py (force_bound is a list so it doesn't make sense)