Luthaf / rascaline

Computing representations for atomistic machine learning
https://luthaf.fr/rascaline/
BSD 3-Clause "New" or "Revised" License
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Added comment for gamma calculations #111

Closed PicoCentauri closed 2 years ago

PicoCentauri commented 2 years ago

small comment for readers to highlight gamma calculations in SOAP radial integral because it is a bit hidden.

github-actions[bot] commented 2 years ago

The documentation for this PR is (or will soon be) available on readthedocs: https://rascaline--111.org.readthedocs.build/en/111/