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Improvements to the `TDOuput = n_excited_el` option

Description

Improvements to the TDOuput = n_excited_el option:

  • When we compute the number of electrons not in valence bands of the GS basis, we only need the occupied states.
  • There is no need to do a reduction for the occ array, as it is shared by all tasks.

News snippet

Improvements to the TDOuput = n_excited_el option.

Checklist

  • I have checked that my code follows the Octopus coding standards
  • [] I have added tests for all the new features added in this request.

Merge request reports

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