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This repository was archived by the owner on Oct 10, 2025. It is now read-only.

Discard everything except evaluation of functions on grids. #38

@tovrstra

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@tovrstra
  • Machinery to build Gaussian basis from molecule and basis set string will move to theochem/gbasis
  • Remove all integrals routines
  • Move remaining grid compute functions outside of the class, make them free functions.

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