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  • #128

Closed
Open
Opened Jul 28, 2017 by Jens Bröder@broederDeveloper

Bug, fleur does not assign core level occupations given in inp.xml

given inp.xml file with 2 species one with a core hole (different corelvel setup) and another without. in the output file, the core setup is the same. also the total energy is not the one I would expect.

Maybe a test case should be added for this feature. @gregor or is there something wrong in my input? inp.xml out.xml

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Reference: fleur/fleur#128