UserWarrning in `_basis.py`

[Andrew-S-Rosen]

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Version

1.1.1

Which OS(es) are you using?

• [ ] MacOS
• [ ] Windows
• [X] Linux

What happened?

When running a model, the following UserWarning is raised in matgl.layers._basis.py:

.../site-packages/matgl/layers/_basis.py:121: UserWarning: To copy construct from a tensor, it is recommended to use sourceTensor.clone().detach() or sourceTensor.clone().detach().requires_grad_(True), rather than torch.tensor(sourceTensor).
  root = torch.tensor(roots[i])

Pretty self-explanatory; line 121 needs updating in _basis.py.

Code snippet

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Log output

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Code of Conduct

• [X] I agree to follow this project's Code of Conduct

[kenko911]

Hi @Andrew-S-Rosen, thanks for reporting this and I have fixed it in the latest update!