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