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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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Add `Atom` and `model` inputs to `ELFTools` class #153

Closed timcallow closed 2 years ago

timcallow commented 2 years ago

This should avoid issues when the localization.ELFTools class is called without a prior call to ISModel.CalcEnergy