GitLab

(not yet complete)

First changes to allow reading of old inp.xml files!

This reverts commit f5fe58e8.

The error message also prints out labels of overlapped
atoms (one of the labels) and the overlapping value.
The error message makes AiiDA-FLEUR to conviniently
parse this info and automatically adjust MT radii
for another try of relaxation.

Repaired most tests. Tests which still  fail have issues with either plotting (25,26), with cdnval (5,16,17,19,20) or have issues of unkown cause (24). Now trying to fix those issues.

Also in this commit: improved Htr to eV factor in evaldos and
                     adapted the related tests.

Tests added: CuBandXML, CuDOSXML.

CuDOSXML does not yet pass.