Title: Dependency management · Issue #165 · microsoft/mattersim · GitHub
Open Graph Title: Dependency management · Issue #165 · microsoft/mattersim
X Title: Dependency management · Issue #165 · microsoft/mattersim
Description: Contact Details No response Bug Description Hi all, could you differentiate those packages in pyproject.toml that are really required to run the forcefield and those that your package should not have any conflicts with and use the latter...
Open Graph Description: Contact Details No response Bug Description Hi all, could you differentiate those packages in pyproject.toml that are really required to run the forcefield and those that your package should not ha...
X Description: Contact Details No response Bug Description Hi all, could you differentiate those packages in pyproject.toml that are really required to run the forcefield and those that your package should not ha...
Opengraph URL: https://github.com/microsoft/mattersim/issues/165
X: @github
Domain: github.com
{"@context":"https://schema.org","@type":"DiscussionForumPosting","headline":"Dependency management","articleBody":"### Contact Details\n\n_No response_\n\n### Bug Description\n\nHi all, \ncould you differentiate those packages in pyproject.toml that are really required to run the forcefield and those that your package should not have any conflicts with and use the latter to run your automatic tests?\n\nCurrently, we cannot re-integrate mattersim easily in atomate2 as it depends on phono3py. I am quite sure that is not used to run the forcefields but rather required for one of your projects.\n\nThanks in advance!\n\n### MatterSim Version\n\ncurrent\n\n### Python Version\n\n3.12\n\n### Reproduction Steps\n\n-\n\n### Expected Behavior\n\nThat i can install it without phono3py.\n\n### Actual Behavior\n\ni have to install phono3py\n\n### Error Logs\n\n```python\n\n```\n\n### Code of Conduct\n\n- [x] I agree to follow the project's Code of Conduct","author":{"url":"https://github.com/JaGeo","@type":"Person","name":"JaGeo"},"datePublished":"2026-06-18T05:45:26.000Z","interactionStatistic":{"@type":"InteractionCounter","interactionType":"https://schema.org/CommentAction","userInteractionCount":1},"url":"https://github.com/165/mattersim/issues/165"}
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