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Published March 24, 2020 | Version 0.1
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blondegeek/e3nn_tutorial: Tutorials now support `e3nn`. Plus, new SphericalTensor methods and notebooks.

Creators

  • 1. @atomicarchitects

Description

  • Tutorials now support e3nn. Special thanks to @JoshRackers for helping with the update.
  • spherical.SphericalTensor now supports angular AND RADIAL Fourier transforms (also called projections)
  • There's a new notebook "Plotting with radial functions" demonstrating these features
  • Stay tuned for a new notebook on predicting electron densities from @JoshRackers.

Files

blondegeek/e3nn_tutorial-0.1.zip

Files (26.4 MB)

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