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Resolve "MPI error with k-point parallelization"

Description

Fix the issues regarding blacs cleanup:

  • call blacs_exit(1) only when running with MPI
  • call blacs_gridinit() at least once, as blacs_exit() raises an MPI error in some versions of OpenMPI

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.

Closes #134 (closed)

Edited by Henning Glawe

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