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theochem / grid

Python library for numerical integration, interpolation, and differentiation on (molecular) grids.
https://grid.qcdevs.org/
GNU Lesser General Public License v3.0
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Enhance 'Angular_grid' notebook #197

Closed marco-2023 closed 11 months ago

marco-2023 commented 1 year ago

This commit refines the 'Angular_grid' notebook by:

  1. Adding examples of grid creation for symmetric spherical grids.
  2. Improving the output formatting of select cells for readability.
  3. Introducing test statements to validate cell results.