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Issues with installation #217

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srmnitc opened this issue Feb 19, 2024 · 1 comment

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srmnitc commented Feb 19, 2024

The installation of atomistics package in a clean env caused the following issues:

phonopy is not automatically installed
structuretoolkit is not installed; and try except block prevents error from being captured

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jan-janssen commented Feb 19, 2024

Yes, both are optional dependencies of the atomistics package:
https://github.com/pyiron/atomistics/blob/main/pyproject.toml#L41

I guess we should update the error message to advise users to install the optional dependencies. @srmnitc Can you open a pull request?

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