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Auger OCA

Bruno Nunes Cabral Tenorio requested to merge auger-oca into master

This branch contains some new functionalities such as the inclusion of Auger spectra computation (one-center approximation based), single site double-core hole (ssDCH) shake-up spectra, and some amendments on the Dyson orbitals computation (such as support to symmetry).

DONE

  • Documentation updated or not needed.
  • Test created.
  • Attribution in source files and CONTRIBUTORS.md updated if necessary.
Edited by Bruno Nunes Cabral Tenorio

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