stfc / janus-core / 10272772891

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Fix sequences of atoms (#245)

* Raise error if sequence passed to single struct calcs

* Test for struct inputs

* Set default read_kwargs for CLI

* Add tests for CLI read kwargs

* Add NaCl trajetory for tests

* Update janus_core/calculations/eos.py

* Clarify reason for limiting ASE index

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Co-authored-by: Alin Marin Elena <alin@elena.re>

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